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Naphthalene, 1-butyl-4-hexyl-1,2,3,4-tetrahydro-

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

Naphthalene, 1-butyl-4-hexyl-1,2,3,4-tetrahydro-
SpectraBase Compound ID KccyCUGyRcZ
InChI InChI=1S/C20H32/c1-3-5-7-8-12-18-16-15-17(11-6-4-2)19-13-9-10-14-20(18)19/h9-10,13-14,17-18H,3-8,11-12,15-16H2,1-2H3
InChIKey BHGRQVRYPGXBEH-UHFFFAOYSA-N
Mol Weight 272.5 g/mol
Molecular Formula C20H32
Exact Mass 272.250401 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 69mb22gxnlA
Name Naphthalene, 1-butyl-4-hexyl-1,2,3,4-tetrahydro-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 272.250401030 u
Formula C20H32
InChI InChI=1S/C20H32/c1-3-5-7-8-12-18-16-15-17(11-6-4-2)19-13-9-10-14-20(18)19/h9-10,13-14,17-18H,3-8,11-12,15-16H2,1-2H3
InChIKey BHGRQVRYPGXBEH-UHFFFAOYSA-N
Molecular Weight 272.476 g/mol
SMILES C12=C(C=CC=C2)C(CCC1CCCCCC)CCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928553