| SpectraBase Spectrum ID |
8uKJYKE6I59 |
| Name |
Benfuresate |
| Source of Sample |
Sigma-Aldrich Cat. #31637 |
| CAS Registry Number |
68505-69-1 |
| 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 |
256.076930165 u |
| Formula |
C12H16O4S |
| InChI |
InChI=1S/C12H16O4S/c1-4-17(13,14)16-9-5-6-11-10(7-9)12(2,3)8-15-11/h5-7H,4,8H2,1-3H3 |
| InChIKey |
QGQSRQPXXMTJCM-UHFFFAOYSA-N |
| Molecular Weight |
256.316 g/mol |
| Number of Peaks |
49 |
| RI1 |
1863 |
| SMILES |
C1(c2c(OC1)ccc(c2)OS(CC)(=O)=O)(C)C |
| SPLASH |
splash10-03di-3910000000-a972b9bfd7973556d222 |
| 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 |
Ethanesulfonic acid, 2,3-dihydro-3,3-dimethyl-5-benzofuranyl ester |
| Wiley ID |
LM_PEST_756 |
