| SpectraBase Spectrum ID |
7R7qxxazgZ6 |
| Name |
3,4-Dichlorophenyl isocyanate |
| Source of Sample |
Sigma-Aldrich Cat. #245607 |
| CAS Registry Number |
102-36-3 |
| Classification |
Pesticides: 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 |
186.959169120 u |
| Formula |
C7H3Cl2NO |
| InChI |
InChI=1S/C7H3Cl2NO/c8-6-2-1-5(10-4-11)3-7(6)9/h1-3H |
| InChIKey |
MFUVCHZWGSJKEQ-UHFFFAOYSA-N |
| Molecular Weight |
188.013 g/mol |
| Number of Peaks |
46 |
| RI1 |
1303 |
| SMILES |
c1(N=C=O)cc(c(cc1)Cl)Cl |
| SPLASH |
splash10-000i-2900000000-eb6d528e23a69a8d7391 |
| 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, 1,2-dichloro-4-isocyanato- |
| Wiley ID |
LM_PEST_883 |
