| SpectraBase Spectrum ID |
FrOMXGUmJPB |
| Name |
Octanoic acid, 7-oxo-6-(phenylthio)-, methyl ester |
| CAS Registry Number |
98711-86-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H20O3S |
| InChI |
InChI=1S/C15H20O3S/c1-12(16)14(10-6-7-11-15(17)18-2)19-13-8-4-3-5-9-13/h3-5,8-9,14H,6-7,10-11H2,1-2H3 |
| InChIKey |
IWKIUTUTTKZFOJ-UHFFFAOYSA-N |
| Molecular Weight |
280.382 g/mol |
| SMILES |
C(Sc1ccccc1)(C(=O)C)CCCCC(=O)OC |
| SPLASH |
splash10-0a4i-0490000000-6fa2cb2504343ef2325f |
| Source of Spectrum |
KC-1985-1243-0 |
| Synonyms |
Methyl 7-oxo-6-(phenylsulfanyl)octanoate
Methyl 7-oxo-6-phenylthio-octanoate |
| Wiley ID |
1283773 |
