| SpectraBase Spectrum ID |
5AtR1deznVP |
| Name |
ORBENCARB |
| CAS Registry Number |
34622-58-7 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 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)16-9-10-7-5-6-8-11(10)13/h5-8H,3-4,9H2,1-2H3 |
| InChIKey |
LLLFASISUZUJEQ-UHFFFAOYSA-N |
| Molecular Weight |
257.779 g/mol |
| Nominal Mass |
257 u |
| Number of Peaks |
66 |
| SMILES |
CCN(CC)C(=O)SCc1ccccc1Cl |
| SPLASH |
splash10-0fk9-9870000000-d7960340438410a972e0 |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
S-(2-chlorobenzyl) diethylthiocarbamate |
| Technique |
GC/MS |
| Wiley ID |
WID_MSPA_4477 |
