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Phenylisocyanate
SpectraBase Compound ID ENiGpwCrwyb
InChI InChI=1S/C7H5NO/c9-6-8-7-4-2-1-3-5-7/h1-5H
InChIKey DGTNSSLYPYDJGL-UHFFFAOYSA-N
Mol Weight 119.12 g/mol
Molecular Formula C7H5NO
Exact Mass 119.037114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HoryQtPb3DV
Name Carbanil
Source of Sample Artifact of N,N'-Diphenylurea
CAS Registry Number 103-71-9
Classification Pesticides: Artifacts
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 119.037113784 u
Formula C7H5NO
InChI InChI=1S/C7H5NO/c9-6-8-7-4-2-1-3-5-7/h1-5H
InChIKey DGTNSSLYPYDJGL-UHFFFAOYSA-N
Molecular Weight 119.123 g/mol
Number of Peaks 58
RI1 957
RI2 950
SMILES c1cccc(c1)N=C=O
SPLASH splash10-02tc-9400000000-f0890a7b00a68a079636
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Benzene, isocyanato-
Wiley ID LM_PEST_1019