| SpectraBase Spectrum ID |
L6UWrvA3yUl |
| Name |
(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl (2R)-2-(4-bromophenyl)-2-hydroxybutanoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
396.130007791 u |
| Formula |
C20H29BrO3 |
| InChI |
1S/C20H29BrO3/c1-5-20(23,15-7-9-16(21)10-8-15)19(22)24-18-12-14(4)6-11-17(18)13(2)3/h7-10,13-14,17-18,23H,5-6,11-12H2,1-4H3/t14-,17+,18-,20-/m1/s1 |
| InChIKey |
JKHALNALZIESND-GVZBARQTSA-N |
| Molecular Weight |
397.353 g/mol |
| SMILES |
C([C@@](O)(C1=CC=C(C=C1)Br)C(O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])=O)C |
