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3,4,5,6,7,8-hexahydro-7-(2-propenyl)-1(2H)-naphthalenone

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

3,4,5,6,7,8-hexahydro-7-(2-propenyl)-1(2H)-naphthalenone
SpectraBase Compound ID 4XLiVIFQs5V
InChI InChI=1S/C13H18O/c1-2-4-10-7-8-11-5-3-6-13(14)12(11)9-10/h2,10H,1,3-9H2
InChIKey HWNAVGJCTUHMJL-UHFFFAOYSA-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 36ZYV9RxR6v
Name 3,4,5,6,7,8-Hexahydro-7-(2-propenyl)-1(2H)-naphthalenone
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/c1-2-4-10-7-8-11-5-3-6-13(14)12(11)9-10/h2,10H,1,3-9H2
InChIKey HWNAVGJCTUHMJL-UHFFFAOYSA-N
Molecular Weight 190.286 g/mol
SMILES C12=C(CCC(C2)CC=C)CCCC1=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.835169