| SpectraBase Compound ID | 17SVlPnEz9k |
|---|---|
| InChI | InChI=1S/C21H30O2/c1-16(9-7-10-17(2)15-20(22)23-6)12-13-19-18(3)11-8-14-21(19,4)5/h7,9-10,12-13,15H,8,11,14H2,1-6H3/b10-7+,13-12+,16-9+,17-15+ |
| InChIKey | SREQLAJQLXPNMC-DXYSAURFSA-N |
| Mol Weight | 314.47 g/mol |
| Molecular Formula | C21H30O2 |
| Exact Mass | 314.22458 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IOjotOM37zn |
|---|---|
| Name | Retinoic acid, methyl ester |
| CAS Registry Number | 339-16-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H30O2 |
| InChI | InChI=1S/C21H30O2/c1-16(9-7-10-17(2)15-20(22)23-6)12-13-19-18(3)11-8-14-21(19,4)5/h7,9-10,12-13,15H,8,11,14H2,1-6H3/b10-7+,13-12+,16-9+,17-15+ |
| InChIKey | SREQLAJQLXPNMC-DXYSAURFSA-N |
| Molecular Weight | 314.469 g/mol |
| SMILES | COC(=O)\C=C/(C)\C=C\C=C/(C)\C=C\C1=C(C)CCCC1(C)C |
| SPLASH | splash10-0a4l-5910000000-4c0517c8f4d6915765a0 |
| Source of Spectrum | W5-28279-0-0 |
| Synonyms | (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoic acid methyl ester (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid methyl ester all-trans-Methylretinoate All-trans-Vitamin A acid methyl ester Methyl (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate Methyl retinoate Retinoic acid, methyl ester, all-trans- Vitamin A acid methyl ester Vitamin A-saeuremethylester BRN 2059353 RO 4-3781 |
| Wiley ID | 1315555 |