| SpectraBase Spectrum ID |
9VPOigD6EuL |
| Name |
2-Thiophenepropanoic acid, .beta.-methyl-, phenylmethyl ester |
| CAS Registry Number |
118110-64-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H16O2S |
| InChI |
InChI=1S/C15H16O2S/c1-12(14-8-5-9-18-14)10-15(16)17-11-13-6-3-2-4-7-13/h2-9,12H,10-11H2,1H3 |
| InChIKey |
JHJMSTJRCJQVCZ-UHFFFAOYSA-N |
| Molecular Weight |
260.351 g/mol |
| SMILES |
c1(sccc1)C(CC(=O)OCc1ccccc1)C |
| SPLASH |
splash10-0006-9000000000-97bed0ec86ed44384db1 |
| Source of Spectrum |
F-44-2061-0 |
| Synonyms |
benzyl 3-(2-thienyl)butanoate |
| Wiley ID |
1263725 |
