| SpectraBase Spectrum ID |
ChQMFXrugDz |
| Name |
Methyl (E)-4-oxo-2-octenethioate |
| Alternate Name(s) |
S-methyl (2E)-4-oxo-2-octenethioate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H14O2S |
| InChI |
InChI=1S/C9H14O2S/c1-3-4-5-8(10)6-7-9(11)12-2/h6-7H,3-5H2,1-2H3/b7-6+ |
| InChIKey |
YCXXPNHSEJWSRF-VOTSOKGWSA-N |
| Molecular Weight |
186.269 g/mol |
| SMILES |
C(\C=C\C(=O)CCCC)(=O)SC |
| SPLASH |
splash10-000i-0900000000-196be1cbd1a9628bd032 |
| Source of Spectrum |
QA-43-284-3 |
| Wiley ID |
862309 |
