| SpectraBase Spectrum ID |
8KPLRpOtGcH |
| Name |
3-Sulfanylhexyl butyrate |
| Source of Sample |
Penta Manifacturing |
| CAS Registry Number |
136954-21-7 |
| 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 |
204.118401056 u |
| Formula |
C10H20O2S |
| InChI |
InChI=1S/C10H20O2S/c1-3-5-9(13)7-8-12-10(11)6-4-2/h9,13H,3-8H2,1-2H3 |
| InChIKey |
TZNJKOLXWHXDAF-UHFFFAOYSA-N |
| Molecular Weight |
204.328 g/mol |
| Number of Peaks |
50 |
| RI1 |
1431 |
| RI2 |
1115 |
| RI3 |
1264 |
| RI4 |
1223 |
| RI5 |
1404 |
| SMILES |
SC(CCOC(CCC)=O)CCC |
| SPLASH |
splash10-0076-9000000000-0a2571514ba264e88433 |
| 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 |
1-Hexanol, 3-mercapto- |
| Wiley ID |
LM_FFNSC3_2998 |
