| SpectraBase Spectrum ID |
KESIj7lT6Se |
| Name |
6-Octenoic acid, 4-acetyl-7-methyl-3-oxo-, methyl ester |
| CAS Registry Number |
111422-95-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18O4 |
| InChI |
InChI=1S/C12H18O4/c1-8(2)5-6-10(9(3)13)11(14)7-12(15)16-4/h5,10H,6-7H2,1-4H3 |
| InChIKey |
LDTJHBRMPUOWCK-UHFFFAOYSA-N |
| Molecular Weight |
226.272 g/mol |
| SMILES |
C(CC(=O)OC)(C(CC=C(C)C)C(=O)C)=O |
| SPLASH |
splash10-0006-9400000000-bee5a76756d3bc73dfd3 |
| Source of Spectrum |
F-46-2042-5 |
| Synonyms |
Methyl 4-(3-methyl-2-buten-1-il)-3,5-dioxohexanoate
Methyl 4-acetyl-7-methyl-3-oxo-6-octenoate |
| Wiley ID |
1227295 |
