SpectraBase Spectrum ID |
COYklS2Cfyf |
Name |
4,8-Methanoazulen-9-ol, decahydro-3A,4,8A-trimethyl-7-methylene-, (3A.alpha.,4.alpha.,8.alpha.,8A.alpha.,9S*)-(.+-.)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
220.182715392 u |
Formula |
C15H24O |
InChI |
InChI=1S/C15H24O/c1-10-6-9-14(3)12(16)11(10)13(2)7-5-8-15(13,14)4/h11-12,16H,1,5-9H2,2-4H3/t11-,12+,13-,14+,15-/m1/s1 |
InChIKey |
JKHYQMRSAYOHOA-QKGCVVFFSA-N |
Molecular Weight |
220.356 g/mol |
SMILES |
[C@]12([C@]([C@]3(CCC([C@@]2([C@@]3(O)[H])[H])=C)C)(CCC1)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.894268 |