| SpectraBase Spectrum ID |
ytUwVUgu7x |
| Name |
Propionate |
| Source of Sample |
SAFC Cat.no. W272000 |
| CAS Registry Number |
13532-18-8 |
| 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 |
134.040150734 u |
| Formula |
C5H10O2S |
| InChI |
InChI=1S/C5H10O2S/c1-7-5(6)3-4-8-2/h3-4H2,1-2H3 |
| InChIKey |
DMMJVMYCBULSIS-UHFFFAOYSA-N |
| Molecular Weight |
134.193 g/mol |
| Number of Peaks |
50 |
| RI1 |
1026 |
| RI2 |
697 |
| RI3 |
924 |
| RI4 |
882 |
| RI5 |
1000 |
| SMILES |
COC(CCSC)=O |
| SPLASH |
splash10-075a-9100000000-1eefedb1908edd411978 |
| 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 |
Propanoic acid, 3-(methylthio)-, methyl ester |
| Wiley ID |
LM_FFNSC3_391 |
