| SpectraBase Spectrum ID |
Bj2AMTIjXZP |
| Name |
(E)-4-ketohept-2-enoic acid methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H12O3 |
| InChI |
InChI=1S/C8H12O3/c1-3-4-7(9)5-6-8(10)11-2/h5-6H,3-4H2,1-2H3/b6-5+ |
| InChIKey |
PCPIFYUUXNXLPN-AATRIKPKSA-N |
| Molecular Weight |
156.181 g/mol |
| SMILES |
C(\C=C\C(=O)CCC)(=O)OC |
| SPLASH |
splash10-03dm-9600000000-83f5e3e4b7c62e532790 |
| Source of Spectrum |
J-59-3208-19 |
| Synonyms |
(E)-4-oxo-2-heptenoic acid methyl ester
Methyl (E)-4-oxidanylidenehept-2-enoate
Methyl (E)-4-oxohept-2-enoate |
| Wiley ID |
1153472 |
