SpectraBase Spectrum ID |
GsLi3oqqtiT |
Name |
2(1H)-Naphthalenone, 3,4,4A,5,8,8A-hexahydro-4A-methyl-, trans- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
164.120115134 u |
Formula |
C11H16O |
InChI |
InChI=1S/C11H16O/c1-11-6-3-2-4-9(11)8-10(12)5-7-11/h2-3,9H,4-8H2,1H3 |
InChIKey |
OMGBHCMLAUUNBP-UHFFFAOYSA-N |
Molecular Weight |
164.248 g/mol |
SMILES |
C12(C)C(CC(CC2)=O)CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972696 |