| SpectraBase Spectrum ID |
DVMu77D9j5F |
| Name |
4-alpha-Hydroxy-5-beta-ethoxy-epi-cubenol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.235144887 u |
| Formula |
C17H32O3 |
| InChI |
InChI=1S/C17H32O3/c1-6-20-15-14-13(11(2)3)8-7-12(4)17(14,19)10-9-16(15,5)18/h11-15,18-19H,6-10H2,1-5H3/t12-,13+,14-,15-,16-,17+/m1/s1 |
| InChIKey |
MQOGRIRJXIYHKV-GGGWTEGZSA-N |
| SMILES |
[C@@]12(O)CC[C@@](O)([C@@]([C@]2([C@@](CC[C@]1(C)[H])(C(C)C)[H])[H])(OCC)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917739 |
