| SpectraBase Spectrum ID |
AY18YHTn4lA |
| Name |
S-Methyl thioacetate |
| CAS Registry Number |
1534-08-3 |
| 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 |
90.013935986 u |
| Formula |
C3H6OS |
| InChI |
InChI=1S/C3H6OS/c1-3(4)5-2/h1-2H3 |
| InChIKey |
OATSQCXMYKYFQO-UHFFFAOYSA-N |
| Molecular Weight |
90.140 g/mol |
| Number of Peaks |
45 |
| RI1 |
706 |
| RI2 |
394 |
| RI3 |
529 |
| RI4 |
398 |
| RI5 |
688 |
| SMILES |
CSC(C)=O |
| SPLASH |
splash10-0006-9000000000-09e48cdc437729521fea |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Ethanethioic acid, S-methyl ester |
| Wiley ID |
LM_FFNSC3_3299 |
