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(+-)-(4,4a,5,6,7,8-Hexahydro-4a-methyl-2-naphthalenyl)-1-ethanone
SpectraBase Compound ID Drgi9PZ9trx
InChI InChI=1S/C13H18O/c1-10(14)11-6-8-13(2)7-4-3-5-12(13)9-11/h6,9H,3-5,7-8H2,1-2H3/t13-/m0/s1
InChIKey WOECGDQVBCCVHG-ZDUSSCGKSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KUX5lwaazoQ
Name (+-)-(4,4A,5,6,7,8-hexahydro-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 190.135765199 u
Formula C13H18O
InChI InChI=1S/C13H18O/c1-10(14)11-6-8-13(2)7-4-3-5-12(13)9-11/h6,9H,3-5,7-8H2,1-2H3/t13-/m0/s1
InChIKey WOECGDQVBCCVHG-ZDUSSCGKSA-N
Molecular Weight 190.286 g/mol
SMILES C=1(C=C2CCCC[C@]2(CC1)C)C(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.87254