| SpectraBase Spectrum ID |
1cbXm5inBZ |
| Name |
(+)-(R-1,C-2,C:3,C-6,C)-3-butyl-6-(trans-2-phenylcyclohexyloxy)-4-cyclohexene-1,2-dicarboxylic anhydride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.214409442 u |
| Formula |
C24H30O4 |
| InChI |
InChI=1S/C24H30O4/c1-2-3-9-17-14-15-20(22-21(17)23(25)28-24(22)26)27-19-13-8-7-12-18(19)16-10-5-4-6-11-16/h4-6,10-11,14-15,17-22H,2-3,7-9,12-13H2,1H3/t17-,18-,19+,20+,21-,22+/m1/s1 |
| InChIKey |
OOUWVBMDHNWZHF-OGVIVNNGSA-N |
| Molecular Weight |
382.500 g/mol |
| SMILES |
C1(OC(=O)[C@]2([C@@]1([C@@](O[C@@]1([C@@](C3=CC=CC=C3)(CCCC1)[H])[H])(C=C[C@]2(CCCC)[H])[H])[H])[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.880407 |
