| SpectraBase Spectrum ID |
7spPs7UrXPI |
| Name |
(8as)-(+-)-1,8A-dihydro-6,8A-dimethylazulene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
158.109550451 u |
| Formula |
C12H14 |
| InChI |
InChI=1S/C12H14/c1-10-5-6-11-4-3-8-12(11,2)9-7-10/h3-7,9H,8H2,1-2H3/t12-/m0/s1 |
| InChIKey |
OCWVHGFGENUNAK-LBPRGKRZSA-N |
| Molecular Weight |
158.244 g/mol |
| SMILES |
C1=2[C@](C=CC(=CC2)C)(CC=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95699 |
