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1-(4-Phenylbutyl)-1,2,3,4-tetrahydronaphthalene

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

1-(4-Phenylbutyl)-1,2,3,4-tetrahydronaphthalene
SpectraBase Compound ID 6qmfOn5V3m2
InChI InChI=1S/C20H24/c1-2-9-17(10-3-1)11-4-5-12-18-14-8-15-19-13-6-7-16-20(18)19/h1-3,6-7,9-10,13,16,18H,4-5,8,11-12,14-15H2
InChIKey SNGLBCCTINESPE-UHFFFAOYSA-N
Mol Weight 264.41 g/mol
Molecular Formula C20H24
Exact Mass 264.187801 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LPEqnMDpoFF
Name 1-(4-Phenylbutyl)-1,2,3,4-tetrahydronaphthalene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.187800773 u
Formula C20H24
InChI InChI=1S/C20H24/c1-2-9-17(10-3-1)11-4-5-12-18-14-8-15-19-13-6-7-16-20(18)19/h1-3,6-7,9-10,13,16,18H,4-5,8,11-12,14-15H2
InChIKey SNGLBCCTINESPE-UHFFFAOYSA-N
Molecular Weight 264.412 g/mol
SMILES C(CCCC=1C=CC=CC1)C1CCCC=2C=CC=CC12
Spectrum/Structure Validation Score (Vapor Phase IR) 0.884013