| SpectraBase Spectrum ID |
ItZV9BgCxHk |
| Name |
Cyclohexane, 1,5-diethenyl-3-methyl-2-methylene-, (1.alpha.,3.alpha.,5.alpha.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
162.140850580 u |
| Formula |
C12H18 |
| InChI |
InChI=1S/C12H18/c1-5-11-7-9(3)10(4)12(6-2)8-11/h5-6,9,11-12H,1-2,4,7-8H2,3H3 |
| InChIKey |
ZXXPVGVXFJQSEU-UHFFFAOYSA-N |
| Molecular Weight |
162.276 g/mol |
| SMILES |
C=CC1C(=C)C(C)CC(C1)C=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.834465 |
