| SpectraBase Spectrum ID |
HvBTwxhBgvT |
| Name |
Benzenehexanoic acid, .beta.-oxo-.gamma.-propyl-, methyl ester |
| Alternate Name(s) |
Methyl 3-oxo-4-(2-phenylethyl)heptanoate |
| CAS Registry Number |
104620-15-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22O3 |
| InChI |
InChI=1S/C16H22O3/c1-3-7-14(15(17)12-16(18)19-2)11-10-13-8-5-4-6-9-13/h4-6,8-9,14H,3,7,10-12H2,1-2H3 |
| InChIKey |
VLWGHJHATYHKLK-UHFFFAOYSA-N |
| Molecular Weight |
262.349 g/mol |
| SMILES |
C(C(=O)C(CCc1ccccc1)CCC)C(=O)OC |
| SPLASH |
splash10-056r-0900000000-6434f260cdc39e410178 |
| Source of Spectrum |
C-108-7689-7 |
| Wiley ID |
1266125 |
