| SpectraBase Spectrum ID |
Krv1np7isYI |
| Name |
2(3H)-Benzofuranone, hexahydro-3A,7A-dimethyl-, cis- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
168.115029753 u |
| Formula |
C10H16O2 |
| InChI |
InChI=1S/C10H16O2/c1-9-5-3-4-6-10(9,2)12-8(11)7-9/h3-7H2,1-2H3/t9-,10-/m0/s1 |
| InChIKey |
RWZWYUVFFQBLCA-UWVGGRQHSA-N |
| Molecular Weight |
168.236 g/mol |
| SMILES |
C[C@]12CCCC[C@]2(C)OC(C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.823032 |
