| SpectraBase Spectrum ID |
AH34HGrZkBf |
| Name |
(3as,6as)-3A,6,6-Trimethyl-3,4,5,6A-tetrahydro-2H-pentalen-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
166.135765199 u |
| Formula |
C11H18O |
| InChI |
InChI=1S/C11H18O/c1-10(2)6-7-11(3)5-4-8(12)9(10)11/h9H,4-7H2,1-3H3/t9-,11+/m0/s1 |
| InChIKey |
VFRXUHGKZGDITM-GXSJLCMTSA-N |
| Molecular Weight |
166.264 g/mol |
| SMILES |
[C@]12([C@](C(C)(C)CC2)(C(=O)CC1)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96681 |
