| SpectraBase Spectrum ID |
7cmyNubWQfr |
| Name |
Angelic acid-(3-formyl-2,4,4-trimethyl-2,5-cyclohexadien-1-ylester) |
| Alternate Name(s) |
3-formyl-2,4,4-trimethylcyclohexa-2,5-dien-1-yl (Z)-2-methylbut-2-enoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H20O3 |
| InChI |
InChI=1S/C15H20O3/c1-6-10(2)14(17)18-13-7-8-15(4,5)12(9-16)11(13)3/h6-9,13H,1-5H3/b10-6- |
| InChIKey |
SQGQFWUDVORSFE-POHAHGRESA-N |
| Literature Reference DOI |
10.1002/cber.19751080842 |
| Molecular Weight |
248.322 g/mol |
| SMILES |
C(\C(C)=C/C)(OC1C=CC(C(=C1C)C=O)(C)C)=O |
| SPLASH |
splash10-001i-9510000000-5a7f2a737b7967356d1a |
| Source of Spectrum |
K-108-2823-5 |
| Wiley ID |
1794032 |
