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2,4,6-Tris(cyclohexyl)hept-1-ene

View entire compound with spectra: 1 FTIR

2,4,6-Tris(cyclohexyl)hept-1-ene
SpectraBase Compound ID 6TqUdnDRGqI
InChI InChI=1S/C25H44/c1-20(22-12-6-3-7-13-22)18-25(24-16-10-5-11-17-24)19-21(2)23-14-8-4-9-15-23/h21-25H,1,3-19H2,2H3
InChIKey LSFOTYVFQHWDNN-UHFFFAOYSA-N
Mol Weight 344.6 g/mol
Molecular Formula C25H44
Exact Mass 344.344301 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BBtooqf4N14
Name 2,4,6-Tris(cyclohexyl)hept-1-ene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.344301417 u
Formula C25H44
InChI InChI=1S/C25H44/c1-20(22-12-6-3-7-13-22)18-25(24-16-10-5-11-17-24)19-21(2)23-14-8-4-9-15-23/h21-25H,1,3-19H2,2H3
InChIKey LSFOTYVFQHWDNN-UHFFFAOYSA-N
Molecular Weight 344.627 g/mol
SMILES C(CC(CC(C)C1CCCCC1)C1CCCCC1)(C1CCCCC1)=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.931828