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1,1'-Biphenyl, 2-fluoro-4-(4-pentylcyclohexyl)-4'-(4-propylcyclohexyl)-, [trans(trans)]-

View entire compound with spectra: 1 MS (GC)

1,1'-Biphenyl, 2-fluoro-4-(4-pentylcyclohexyl)-4'-(4-propylcyclohexyl)-, [trans(trans)]-
SpectraBase Compound ID GlkQQYtAvCL
InChI InChI=1S/C32H45F/c1-3-5-6-8-25-11-15-28(16-12-25)30-21-22-31(32(33)23-30)29-19-17-27(18-20-29)26-13-9-24(7-4-2)10-14-26/h17-26,28H,3-16H2,1-2H3/t24-,25-,26-,28-
InChIKey SYCNHFWYTQQMNG-AFMUELSESA-N
Mol Weight 448.7 g/mol
Molecular Formula C32H45F
Exact Mass 448.35053 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4qkbLt1C9R
Name 1,1'-Biphenyl, 2-fluoro-4-(4-pentylcyclohexyl)-4'-(4-propylcyclohexyl)-, [trans(trans)]-
Alternate Name(s) 2-Fluoro-4-(4-pentylcyclohexyl)-4'-(4-propylcyclohexyl)-1,1'-biphenyl 4-[p-pentyl-p-(p-propylcyclohexyl)]cyclohexyl-2-fluoro-1,1'-biphenyl
CAS Registry Number 106349-49-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H45F
InChI InChI=1S/C32H45F/c1-3-5-6-8-25-11-15-28(16-12-25)30-21-22-31(32(33)23-30)29-19-17-27(18-20-29)26-13-9-24(7-4-2)10-14-26/h17-26,28H,3-16H2,1-2H3/t24-,25-,26-,28-
InChIKey SYCNHFWYTQQMNG-AFMUELSESA-N
Molecular Weight 448.710 g/mol
SMILES c1(c(ccc(c1)[C@]1(CC[C@@](CC1)(CCCCC)[H])[H])-c1ccc(cc1)[C@]1(CC[C@@](CC1)(CCC)[H])[H])F
SPLASH splash10-0002-9241500000-3fd40348518a04e4a2ef
Source of Spectrum O-25-685-24
Wiley ID 1387378