| SpectraBase Spectrum ID |
Igd4yDERRcd |
| Name |
Retinoic acid, 5,6-dihydro-5,6-dihydroxy-, methyl ester, (5R,6R)-(.+-.)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.230059506 u |
| Formula |
C21H32O4 |
| InChI |
InChI=1S/C21H32O4/c1-16(9-7-10-17(2)15-18(22)25-6)11-14-21(24)19(3,4)12-8-13-20(21,5)23/h7,9-11,14-15,23-24H,8,12-13H2,1-6H3/b10-7+,14-11+,16-9+,17-15+/t20-,21-/m1/s1 |
| InChIKey |
RZAQIXABEIOMSQ-DAYUCEGYSA-N |
| Molecular Weight |
348.483 g/mol |
| SMILES |
[C@]1(\C=C\C(=C\C=C\C(=C\C(=O)OC)C)C)([C@](O)(CCCC1(C)C)C)O |
