| SpectraBase Spectrum ID |
63z6Jg2SMw |
| Name |
m-Methylphenyl isocyanate |
| Source of Sample |
Degradation product of Phenmedipham |
| CAS Registry Number |
621-29-4 |
| Classification |
Pesticides: Artifacts, Degradation product |
| 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 |
133.052763848 u |
| Formula |
C8H7NO |
| InChI |
InChI=1S/C8H7NO/c1-7-3-2-4-8(5-7)9-6-10/h2-5H,1H3 |
| InChIKey |
CPPGZWWUPFWALU-UHFFFAOYSA-N |
| Molecular Weight |
133.150 g/mol |
| Number of Peaks |
75 |
| RI1 |
1059 |
| SMILES |
Cc1cccc(c1)N=C=O |
| SPLASH |
splash10-0f89-5900000000-c1b7319bf642e9a20c7f |
| 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, 1-isocyanato-3-methyl- |
| Wiley ID |
LM_PEST_1265 |
