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  • Analytical Chemistry and Spectroscopy  (130)
  • 1980-1984  (99)
  • 1970-1974  (31)
  • 1980  (99)
  • 1972  (31)
Collection
Publisher
Years
  • 1980-1984  (99)
  • 1970-1974  (31)
Year
  • 1
    ISSN: 1052-9306
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: As part of a study to make a comparative analysis of selected halogenated compounds in man and the environmental media, a quantitative gas chromatographic mass spectrometric analysis of the levels of the halogenated compounds found in the breath, blood and urine of an exposed population (Old Love Canal area, Niagara, New York) and their immediate environment (air and water) was undertaken. In addition, levels of halogenated hydrocarbons in air samples taken in the general Buffalo, Niagara Falls area were determined.
    Additional Material: 8 Ill.
    Type of Medium: Electronic Resource
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  • 2
    Electronic Resource
    Electronic Resource
    Chichester [u.a.] : Wiley-Blackwell
    Journal of Raman Spectroscopy 9 (1980), S. 230-238 
    ISSN: 0377-0486
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Physics
    Notes: The IR spectra (1400 cm-1 to 160 cm-1) of the gases at ambient temperature and the Raman spectra (below 1400 cm-1) of the liquids near -196°C are reported for CF3OF and CF3OCl. All fundamentals are assigned under Cs symmetry and the results of a normal coordinate analysis are presented. The assignments of Smardzewski and Fox are adopted with one exception for both CF3OF and CF3OCl: the CF3 rock of A″ symmetry is assigned near 430 cm-1 and the two bands between 200 cm-1 and 300 cm-1 are assigned to an A′ fundamental, involving CF3 rocking and COX bending and a Δν=2 transition in the CF3 torsion. An extra band at 548 cm-1 in the Raman spectrum of liquid CF3 COl near -196°C is assigned to a CF3OCl⃛Cl2 complex. The values of the force constants d(OX) for CF3OX molecules are suggested to be near those for X2O molecules. More than half the normal modes of A′ symmetry show extensive mixing of symmetry coordinates. In some of these cases the symmetry coordinate for which the normal mode is named is the largest but not the dominant contributor to the potential energy distribution, while in others this symmetry coordinate is not even the largest contributor to the potential energy distribution. No normal modes of A′ symmetry are present in which ν(CO), δs(CF3), δ(COX), or δ(CF3) symmetry coordinates are dominant, and the mode conventionally labeled as v(CO) should be labeled as νs(CF3). For the remaining A′ normal modes and all the A″ normal modes, the symmetry coordinate for which the normal mode is named is dominant in the potential energy distribution.
    Additional Material: 3 Ill.
    Type of Medium: Electronic Resource
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  • 3
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Organic Magnetic Resonance 4 (1972), S. 309-319 
    ISSN: 0030-4921
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: A 220 MHz NMR spectrometer has been used to identify the structure of polychlorinated biphenyls (PCBs). The proton chemical shifts and approximate coupling constants of PCBs fractionated from Aroclor 1254 are given in the text. The spectra of model compounds are included in the supplement. The chemical shifts are also tabulated according to the ring substitution pattern, when it can be seen that the shifts change systematically with the degree of both the total ring substitution and the substitution in the positions ‘ortho’ to the bridging bond between the rings.
    Additional Material: 1 Ill.
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  • 4
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Organic Magnetic Resonance 4 (1972), S. 343-352 
    ISSN: 0030-4921
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: The complete analyses of the 19F spectra of some fluorinated benzofurans are given. These provide an unambiguous determination of the substituent position in these compounds. Comparison of the 19F SCS and coupling constants in the benzofuran, benzothiophene and benzene series shows that 19F spectral parameters can be transposed from the benzene series with caution.A large increase in the para F—F coupling with ring closure of the hetero-ring is noteworthy. A long-range through-space 8JH is reported which arises from the proximity of the 3 carboethoxy methyl group and the C4 fluorine in these molecules.
    Additional Material: 2 Ill.
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  • 5
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Organic Magnetic Resonance 13 (1980), S. 143-147 
    ISSN: 0030-4921
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Two resonance lines were observed in 2,6-dichlorobenzamide, both in liquid nitrogen and at room temperatures, using a self quenched super-regenerative NQR spectrometer. Analysis of the Zeeman effect on the two lines using an uncut crystal grown from solution reveals: (1) the crystal belongs to the orthorhombic system; (2) there are two crystallographically equivalent but physically non-equivalent directions for the principal field gradient making an angle of 71° for the low frequency line, and four such directions for the high frequency line; (3) the directions of the crystalline axes a, b and c are tentatively fixed as (90°, 90°), (90°, 90°) and (0°, - ); (4) from morphological studies a: b: c are estimated as 0.959 ± 0.005: 1:1,402 ± 0.005 and, from the estimated density (1.440 gms/cc) of the crystal, the absolute values a, b, c are calculated, on the basis of four molecules per unit cell, as a = 8.33 Å, b = 8.68 Å and c = 12.18 Å; (5) there are a mininium of four molecules per unit cell; the four molecules lie in four different planes which are, however, connected by symmetry operations. There is an inplane bending by 6.5° between the two C—Cl bonds away from one another and (6) the ionic, single bond and double bond characters for both chlorines are almost equal and are in the ratio 25:72:3.
    Additional Material: 4 Ill.
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  • 6
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Organic Magnetic Resonance 14 (1980), S. 192-197 
    ISSN: 0030-4921
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: The proton spectra of exo- and endo-3-thiatricyclo[4.2.1.02,5]non-7-ene 3,3-dioxide have been analysed and completely assigned. Considerations of coupling constants indicate that the thietane ring is nonplanar and that the norbornene residue is significantly distorted from the geometry of norbornene itself. The sulfone group induces significant changes in the shielding of the proximate olefinic proton in the endo isomer and the bridge protons in the exo isomer. These shifts appear to be the result of the electrostatic effects and effects associated with the diagmagnetic anisotropy of the sulfone group.
    Additional Material: 3 Ill.
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  • 7
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Organic Magnetic Resonance 14 (1980), S. 410-414 
    ISSN: 0030-4921
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Proton spin-lattice relaxation rates (R1 values) have been measured, at 270 MHz, for a series of 1-aryl-4,4-dimethyl-2-methylthio-2-imidazolin-5-ones, using both null-point and non-linear regression methods; the two procedures give the same rates. A normalization procedure has been used to enable comparisons to be made between the R1 values of different compounds; this is necessary because the experimental values are affected by changes in motional correlation times associated with changes in molecular structure. A substantial (five-fold) dynamic range of R1 values has been observed for the protons of individual compounds, and the values have been correlated with the molecular environments of the nuclei. Evidence for anisotropic molecular motion and inter-ring proton relaxation in these compounds has been considered.
    Additional Material: 1 Ill.
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  • 8
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Biological Mass Spectrometry 6 (1972), S. 923-930 
    ISSN: 0030-493X
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Substituent effects in the electron-impact and field ionization mass spectra of acteophenones are compared. No Hammett correlation could be found for the fragments formed on the surface of the field anode. A straight line log z/z0 versus σ+ was observed, however, for the metastable decomposition of para-substituted acetophenones (and also some benzophenones). Meta-substituted compounds did not yield such straight lines.
    Additional Material: 3 Ill.
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  • 9
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Biological Mass Spectrometry 15 (1980), S. 273-274 
    ISSN: 0030-493X
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Additional Material: 4 Ill.
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  • 10
    ISSN: 1052-9306
    Keywords: Chemistry ; Analytical Chemistry and Spectroscopy
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: The value of selected ion monitoring in analyzing biological radio isotope incorporation experiments by radiogas chromatography mass spectrometry is illustrated with reference to the biosynthesis of the mycotoxin mycophenolic acid and the mode of action of the anticholesterolemic drug 20,25-diazacholesterol. It is shown that the increased sensitivity and specificity of the selected ion monitoring mode detector permits straightforward detection and identification of the relatively small cellular pools associated with metabolic intermediates. The computer program RADSIM is described. Problems that still exist in using radiogas gas chromatography mass spectrometry technology to analyse isotope incorporation experiments are discussed.
    Additional Material: 5 Ill.
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