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Benzoyl isocyanate

View entire compound with spectra: 4 NMR, 2 FTIR, and 1 MS (GC)

Benzoyl isocyanate
SpectraBase Compound ID 2CQNibCcpaO
InChI InChI=1S/C8H5NO2/c10-6-9-8(11)7-4-2-1-3-5-7/h1-5H
InChIKey LURYMYITPCOQAU-UHFFFAOYSA-N
Mol Weight 147.13 g/mol
Molecular Formula C8H5NO2
Exact Mass 147.032028 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DMJGWbOwad6
Name BENZOYLISOCYANATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H5NO2
InChI InChI=1S/C8H5NO2/c10-6-9-8(11)7-4-2-1-3-5-7/h1-5H
InChIKey LURYMYITPCOQAU-UHFFFAOYSA-N
Literature Reference Author H.DAHN,P.PECHY,V.V.TOAN
Literature Reference Citation MAGN.RES.CHEM.,35,589(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199709)35:9<589::aid-omr134>3.0.co;2-l
Solvent CH3CN
Source File Reference UWSI8266