| SpectraBase Spectrum ID |
D98rstL0LUS |
| Name |
4-methyl-2-(phenylthio)penta-2,3-dienoic acid methyl ester |
| Alternate Name(s) |
methyl 4-methyl-2-(phenylsulfanyl)-2,3-pentadienoate
methyl 4-methyl-2-phenylsulfanyl-penta-2,3-dienoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14O2S |
| InChI |
InChI=1S/C13H14O2S/c1-10(2)9-12(13(14)15-3)16-11-7-5-4-6-8-11/h4-8H,1-3H3 |
| InChIKey |
AKLCGTJTQMXROV-UHFFFAOYSA-N |
| Molecular Weight |
234.313 g/mol |
| SMILES |
C(C(=C=C(C)C)Sc1ccccc1)(=O)OC |
| SPLASH |
splash10-000i-9030000000-a17c827ee6565bfbb9b8 |
| Source of Spectrum |
SO-0-13-4 |
| Wiley ID |
1541949 |
