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1-([4-(4-Butylcyclohexyl)phenyl]ethynyl)-2,4-dimethylbenzene
SpectraBase Compound ID 7dFJQeNRxNJ
InChI InChI=1S/C26H32/c1-4-5-6-22-9-15-25(16-10-22)26-17-11-23(12-18-26)8-14-24-13-7-20(2)19-21(24)3/h7,11-13,17-19,22,25H,4-6,9-10,15-16H2,1-3H3
InChIKey KXYGCLVZIVFBDS-UHFFFAOYSA-N
Mol Weight 344.5 g/mol
Molecular Formula C26H32
Exact Mass 344.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FBWQJOC2K1
Name 1-([4-(4-Butylcyclohexyl)phenyl]ethynyl)-2,4-dimethylbenzene
CAS Registry Number 114834-76-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H32
InChI InChI=1S/C26H32/c1-4-5-6-22-9-15-25(16-10-22)26-17-11-23(12-18-26)8-14-24-13-7-20(2)19-21(24)3/h7,11-13,17-19,22,25H,4-6,9-10,15-16H2,1-3H3
InChIKey KXYGCLVZIVFBDS-UHFFFAOYSA-N
Molecular Weight 344.542 g/mol
SMILES C(#Cc1ccc(cc1)C1CCC(CC1)CCCC)c1c(cc(cc1)C)C
SPLASH splash10-00kf-5597000000-aa90277b873b75a7420d
Source of Spectrum O-26-141-19
Synonyms 1-[2-[4-(4-butylcyclohexyl)phenyl]ethynyl]-2,4-dimethyl-benzene Benzene, 1-[[4-(4-butylcyclohexyl)phenyl]ethynyl]-2,4-dimethyl-
Wiley ID 1338437