| SpectraBase Spectrum ID |
8nuadufm6Xl |
| Name |
1-Isopropyl-3,6-dimethyl-1A,2,3,5,6,6B-hexahydro-1H-cyclopropa[E]inden-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
218.167065327 u |
| Formula |
C15H22O |
| InChI |
InChI=1S/C15H22O/c1-7(2)12-10-5-8(3)13-11(16)6-9(4)14(13)15(10)12/h7-10,12,15H,5-6H2,1-4H3 |
| InChIKey |
CVRLDQBNXGDFMD-UHFFFAOYSA-N |
| Molecular Weight |
218.340 g/mol |
| SMILES |
C1(CC(C=2C3C(CC(C12)C)C3C(C)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929608 |
![1-Isopropyl-3,6-dimethyl-1a,2,3,5,6,6b-hexahydro-1H-cyclopropa[e]inden-4-one](/api/spectrum/8nuadufm6Xl/structure.png?h=300&w=458 "1-Isopropyl-3,6-dimethyl-1a,2,3,5,6,6b-hexahydro-1H-cyclopropa[e]inden-4-one")
