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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

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 9jU7E1x8BnH
Name Benzoyl isocyanate
Source of Sample Aldrich
Catalog Number 308188
CAS Registry Number 4461-33-0
Classification Aromatic nitriles & cumulated double bonds
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. 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
Purity 90%
Source of Spectrum Sigma-Aldrich Co. LLC.
Technique Neat
Wiley ID SIAL_FTIR_1_6463