| SpectraBase Spectrum ID |
FCv62iP9bz1 |
| Name |
[(1R-(1.alpha.,3A.alpha.,3B.beta.,6.beta.,6A.beta.,6B.alpha.)]-decahydro-.alpha.,.alpha.,3A,6-tetramethyl-1-cyclobuta[1,2:3,4]dicyclopentanemethanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
222.198365456 u |
| Formula |
C15H26O |
| InChI |
InChI=1S/C15H26O/c1-9-5-6-10-12(9)13-11(14(2,3)16)7-8-15(10,13)4/h9-13,16H,5-8H2,1-4H3/t9-,10-,11-,12+,13-,15+/m1/s1 |
| InChIKey |
ODNYWCNTMPCHTB-LREAXHOUSA-N |
| Molecular Weight |
222.372 g/mol |
| SMILES |
[C@]12([C@@]([C@](C(O)(C)C)(CC2)[H])([H])[C@@]2([C@]1(CC[C@]2(C)[H])[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944667 |