| SpectraBase Spectrum ID |
45djHJdt3e1 |
| Name |
Pentanone <4-Mercapto-4-methyl-2-> |
| Source of Sample |
Riverside Aromatics Cat.no. NM9101 |
| CAS Registry Number |
19872-52-7 |
| 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 |
132.060886179 u |
| Formula |
C6H12OS |
| InChI |
InChI=1S/C6H12OS/c1-5(7)4-6(2,3)8/h8H,4H2,1-3H3 |
| InChIKey |
QRNZMFDCKKEPSX-UHFFFAOYSA-N |
| Molecular Weight |
132.221 g/mol |
| Number of Peaks |
50 |
| RI1 |
940 |
| RI2 |
630 |
| SMILES |
CC(=O)CC(C)(C)S |
| SPLASH |
splash10-0006-9000000000-9c050fa261ea9e84cc21 |
| 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 |
2-Mercapto-2-methylpentan-4-one |
| Wiley ID |
LM_FFNSC3_2056 |
