| SpectraBase Spectrum ID |
8oaBEmQijnP |
| Name |
2-Hexenoic acid, 3,4,4-trimethyl-5-oxo-, ethyl ester, (E)- |
| CAS Registry Number |
6994-98-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H18O3 |
| InChI |
InChI=1S/C11H18O3/c1-6-14-10(13)7-8(2)11(4,5)9(3)12/h7H,6H2,1-5H3/b8-7+ |
| InChIKey |
QUGUUJPRLFZYFC-BQYQJAHWSA-N |
| Molecular Weight |
198.262 g/mol |
| SMILES |
C(\C(=C\C(OCC)=O)C)(C)(C(C)=O)C |
| SPLASH |
splash10-0a6u-9700000000-9ec2da56975ec4240ae2 |
| Source of Spectrum |
T-68-2271-0 |
| Synonyms |
Ethyl (2E)-3,4,4-trimethyl-5-oxo-2-hexenoate
(E)-3,4,4-trimethyl-5-oxo-2-hexenoic acid ethyl ester
(E)-5-keto-3,4,4-trimethyl-hex-2-enoic acid ethyl ester
Ethyl (E)-3,4,4-trimethyl-5-oxidanylidene-hex-2-enoate
Ethyl (E)-3,4,4-trimethyl-5-oxo-hex-2-enoate |
| Wiley ID |
1195465 |
