| SpectraBase Spectrum ID |
2vr9OpDQWEW |
| Name |
Pentanoic acid, 4-oxo-5-(phenylthio)-, methyl ester |
| CAS Registry Number |
85492-86-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H14O3S |
| InChI |
InChI=1S/C12H14O3S/c1-15-12(14)8-7-10(13)9-16-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3 |
| InChIKey |
HGXMTPLNAGECMI-UHFFFAOYSA-N |
| Molecular Weight |
238.301 g/mol |
| SMILES |
C(=O)(CCC(=O)CSc1ccccc1)OC |
| SPLASH |
splash10-03dr-0690000000-20cbb6dea8c0ef89b8f6 |
| Source of Spectrum |
KC-1986-2003-0 |
| Synonyms |
4-keto-5-(phenylthio)valeric acid methyl ester
4-Oxo-5-(phenylthio)pentanoic acid methyl ester
Methyl 4-oxidanylidene-5-phenylsulfanyl-pentanoate
Methyl 4-oxo-5-phenylsulfanylpentanoate |
| Wiley ID |
1240240 |
