SpectraBase Spectrum ID |
7MkuS9Z24Ig |
Name |
(4A.alpha.,8A.beta.)-(+-)-(3,4,4A,5,6,7,8,8A-octahydro-4A-methyl-2-naphthalenyl)-1-ethanone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
192.151415263 u |
Formula |
C13H20O |
InChI |
InChI=1S/C13H20O/c1-10(14)11-6-8-13(2)7-4-3-5-12(13)9-11/h9,12H,3-8H2,1-2H3/t12?,13-/m0/s1 |
InChIKey |
HXLLQDHOWRFLFY-ABLWVSNPSA-N |
Molecular Weight |
192.302 g/mol |
SMILES |
C1(=CC2CCCC[C@]2(CC1)C)C(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.93488 |