| SpectraBase Spectrum ID |
9PCCGX2djan |
| Name |
3-Cyclohexene-1-carboxylic acid, 6-(8-hydroxyhexyl)-2-oxo-4-(phenylmethoxy)-, methyl ester |
| CAS Registry Number |
65716-48-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H32O5 |
| InChI |
InChI=1S/C23H32O5/c1-27-23(26)22-19(13-9-4-2-3-5-10-14-24)15-20(16-21(22)25)28-17-18-11-7-6-8-12-18/h6-8,11-12,16,19,22,24H,2-5,9-10,13-15,17H2,1H3 |
| InChIKey |
SNVQSUMERJSAKQ-UHFFFAOYSA-N |
| Molecular Weight |
388.504 g/mol |
| SMILES |
OCCCCCCCCC1C(C(C=C(C1)OCc1ccccc1)=O)C(=O)OC |
| SPLASH |
splash10-0006-9000000000-208927920524359b5a01 |
| Source of Spectrum |
H-60-2869-0 |
| Synonyms |
methyl 4-(benzyloxy)-6-(8-hydroxyoctyl)-2-oxo-3-cyclohexene-1-carboxylate
Methyl 4-benzyloxy-6-(8-hydroxyoctyl)-2-oxo-3-cyclohexen-carbonate |
| Wiley ID |
1363950 |
