| SpectraBase Spectrum ID |
IoPdiEtTaFX |
| Name |
(1R*,2R*/S*,4R*,5S*)-2-Methyl-3-oxa-4-(2-propyl)bicyclo[3.3.0]-octan-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
184.146329882 u |
| Formula |
C11H20O2 |
| InChI |
InChI=1S/C11H20O2/c1-7(2)10-9-5-4-6-11(9,12)8(3)13-10/h7-10,12H,4-6H2,1-3H3/t8-,9+,10-,11+/m1/s1 |
| InChIKey |
LITOTOGUJMZYIT-YTWAJWBKSA-N |
| Molecular Weight |
184.279 g/mol |
| SMILES |
[C@]12([C@]([C@@](C(C)C)(O[C@@]2(C)[H])[H])(CCC1)[H])O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95023 |
![(1R*,2R*/S*,4R*,5S*)-2-Methyl-3-oxa-4-(2-propyl)bicyclo[3.3.0]-octan-1-ol](/api/spectrum/IoPdiEtTaFX/structure.png?h=300&w=458 "(1R*,2R*/S*,4R*,5S*)-2-Methyl-3-oxa-4-(2-propyl)bicyclo[3.3.0]-octan-1-ol")
