| SpectraBase Spectrum ID |
HJ3kkw9CCCk |
| Name |
Benzoic acid, 2,4-dihydroxy-6-(2-oxopentyl)-, phenylmethyl ester |
| CAS Registry Number |
127743-31-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H20O5 |
| InChI |
InChI=1S/C19H20O5/c1-2-6-15(20)9-14-10-16(21)11-17(22)18(14)19(23)24-12-13-7-4-3-5-8-13/h3-5,7-8,10-11,21-22H,2,6,9,12H2,1H3 |
| InChIKey |
AVSIHXMBOQLYED-UHFFFAOYSA-N |
| Molecular Weight |
328.364 g/mol |
| SMILES |
Oc1cc(cc(c1C(OCc1ccccc1)=O)CC(=O)CCC)O |
| SPLASH |
splash10-0006-9000000000-77e3c6c8672c76ed8cda |
| Source of Spectrum |
B-42-1975-19 |
| Synonyms |
Benzyl 2,4-dihydroxy-6-(2-oxopentyl)benzoate
Ethyl 2-benzyloxy-3-formyl-4-methoxy-6-methylbenzoate |
| Wiley ID |
1326358 |
