| SpectraBase Spectrum ID |
9BomCB8HB4H |
| Name |
Thiobencarb |
| Source of Sample |
Sigma-Aldrich Cat. #45687 |
| CAS Registry Number |
28249-77-6 |
| Classification |
Pesticides: Herbicides |
| 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 |
257.064113012 u |
| Formula |
C12H16ClNOS |
| InChI |
InChI=1S/C12H16ClNOS/c1-3-14(4-2)12(15)16-9-10-5-7-11(13)8-6-10/h5-8H,3-4,9H2,1-2H3 |
| InChIKey |
QHTQREMOGMZHJV-UHFFFAOYSA-N |
| Molecular Weight |
257.779 g/mol |
| Number of Peaks |
43 |
| RI1 |
1968 |
| SMILES |
c1c(CSC(N(CC)CC)=O)ccc(c1)Cl |
| SPLASH |
splash10-0uk9-8900000000-0782cca8bd128d110aa1 |
| 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 |
Carbamothioic acid, N,N-diethyl-, S-[(4-chlorophenyl)methyl] ester |
| Wiley ID |
LM_PEST_140 |
