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Trans-1-[trans-4-(4-penten-1-yl)cyclohexyl]-4-pentylcyclohexane

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

Trans-1-[trans-4-(4-penten-1-yl)cyclohexyl]-4-pentylcyclohexane
SpectraBase Compound ID 6Q0Uu70dQMS
InChI InChI=1S/C22H40/c1-3-5-7-9-19-11-15-21(16-12-19)22-17-13-20(14-18-22)10-8-6-4-2/h3,19-22H,1,4-18H2,2H3/t19-,20-,21-,22-
InChIKey NBJWSNJMEFKUNF-CHDDOINTSA-N
Mol Weight 304.6 g/mol
Molecular Formula C22H40
Exact Mass 304.313001 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lb7L7ToFtqZ
Name Trans-1-[trans-4-(4-penten-1-yl)cyclohexyl]-4-pentylcyclohexane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 304.313001288 u
Formula C22H40
InChI InChI=1S/C22H40/c1-3-5-7-9-19-11-15-21(16-12-19)22-17-13-20(14-18-22)10-8-6-4-2/h3,19-22H,1,4-18H2,2H3/t19-,20-,21-,22-
InChIKey NBJWSNJMEFKUNF-CHDDOINTSA-N
Molecular Weight 304.562 g/mol
SMILES [C@]1([C@]2(CC[C@@](CC2)(CCCC=C)[H])[H])(CC[C@](CC1)(CCCCC)[H])[H]