| SpectraBase Spectrum ID |
15Pkbq6b7w7 |
| Name |
3-(Acetylthio)-2-methylfuran |
| CAS Registry Number |
55764-25-5 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
156.024500670 u |
| Formula |
C7H8O2S |
| InChI |
InChI=1S/C7H8O2S/c1-5-7(3-4-9-5)10-6(2)8/h3-4H,1-2H3 |
| InChIKey |
PQFIBPDAGFGLBY-UHFFFAOYSA-N |
| Molecular Weight |
156.199 g/mol |
| Number of Peaks |
50 |
| RI1 |
1123 |
| RI2 |
800 |
| RI3 |
1084 |
| RI4 |
1042 |
| RI5 |
1099 |
| SMILES |
C(C)(=O)Sc1c(occ1)C |
| SPLASH |
splash10-03dl-9600000000-0c16bd888a7777ae5cb9 |
| 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-(2-methyl-3-furanyl) ester |
| Wiley ID |
LM_FFNSC3_3104 |
