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1-{trans-4-((E)-3,4-Difluoro-3-butenyl)cyclohexyl}-trans-4-pentylcyclohexane

View entire compound with spectra: 1 MS (GC)

1-{trans-4-((E)-3,4-Difluoro-3-butenyl)cyclohexyl}-trans-4-pentylcyclohexane
SpectraBase Compound ID 72zoYsdhbzD
InChI InChI=1S/C21H36F2/c1-2-3-4-5-17-6-11-19(12-7-17)20-13-8-18(9-14-20)10-15-21(23)16-22/h16-20H,2-15H2,1H3/b21-16+/t17-,18?,19-,20?
InChIKey REQZPQUNBCXKLX-PZNOMMCISA-N
Mol Weight 326.5 g/mol
Molecular Formula C21H36F2
Exact Mass 326.278507 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7nSEuLBriNv
Name 1-{trans-4-((E)-3,4-Difluoro-3-butenyl)cyclohexyl}-trans-4-pentylcyclohexane
Alternate Name(s) 1-[(3E)-3,4-difluorobut-3-en-1-yl]-4-(4-pentylcyclohexyl)cyclohexane 1-{trans-1-[(E)-3,4-Difluoro-3-butenyl)cyclohexyl]-trans-4-pentylcyclohexane
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Formula C21H36F2
InChI InChI=1S/C21H36F2/c1-2-3-4-5-17-6-11-19(12-7-17)20-13-8-18(9-14-20)10-15-21(23)16-22/h16-20H,2-15H2,1H3/b21-16+/t17-,18?,19-,20?
InChIKey REQZPQUNBCXKLX-PZNOMMCISA-N
Molecular Weight 326.516 g/mol
SMILES C(\C(=C/F)F)CC1CCC(CC1)[C@]1(CC[C@@](CC1)(CCCCC)[H])[H]
SPLASH splash10-00lr-9100000000-299bc6fe8136294cd3c9
Source of Spectrum AJ-73-1642-6
Wiley ID 775494