| SpectraBase Spectrum ID |
3p0eidqCvfn |
| Name |
(1'S,6rs)-6-Methyl-3-(1',2',2'-trimethylcyclopentyl)-2-hexene-1-one |
| 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/c1-11-6-7-12(10-13(11)16)15(4)9-5-8-14(15,2)3/h10-11H,5-9H2,1-4H3/t11?,15-/m1/s1 |
| InChIKey |
OFWLGIQEVDVZSW-JOPIAHFSSA-N |
| Molecular Weight |
220.356 g/mol |
| SMILES |
C1(=CC(=O)C(CC1)C)[C@@]1(C(CCC1)(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898591 |
