| SpectraBase Spectrum ID |
2LGuEVbFgRm |
| Name |
2(1H)-Naphthalenone, octahydro-4A,5-dimethyl-, (4A.alpha.,5.alpha.,8A.beta.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
180.151415263 u |
| Formula |
C12H20O |
| InChI |
InChI=1S/C12H20O/c1-9-4-3-5-10-8-11(13)6-7-12(9,10)2/h9-10H,3-8H2,1-2H3 |
| InChIKey |
RJUOJHLBLNEZNV-UHFFFAOYSA-N |
| Molecular Weight |
180.291 g/mol |
| SMILES |
C12(C)C(CC(CC2)=O)CCCC1C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977996 |
