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1-Ethyl-4-([4-(4-propylcyclohexyl)phenyl]ethynyl)benzene
SpectraBase Compound ID HNEko8CC5VM
InChI InChI=1S/C25H30/c1-3-5-21-12-16-24(17-13-21)25-18-14-23(15-19-25)11-10-22-8-6-20(4-2)7-9-22/h6-9,14-15,18-19,21,24H,3-5,12-13,16-17H2,1-2H3
InChIKey VWBHMDVHVYVIAR-UHFFFAOYSA-N
Mol Weight 330.52 g/mol
Molecular Formula C25H30
Exact Mass 330.234751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CCVKbHAgqxX
Name 1-Ethyl-4-([4-(4-propylcyclohexyl)phenyl]ethynyl)benzene
Alternate Name(s) 1-Ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene Benzene, 1-[(4-ethylphenyl)ethynyl]-4-(4-propylcyclohexyl)-
CAS Registry Number 107949-21-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30
InChI InChI=1S/C25H30/c1-3-5-21-12-16-24(17-13-21)25-18-14-23(15-19-25)11-10-22-8-6-20(4-2)7-9-22/h6-9,14-15,18-19,21,24H,3-5,12-13,16-17H2,1-2H3
InChIKey VWBHMDVHVYVIAR-UHFFFAOYSA-N
Molecular Weight 330.515 g/mol
SMILES c1c(ccc(C#Cc2ccc(C3CCC(CCC)CC3)cc2)c1)CC
SPLASH splash10-0159-2292000000-37660e9f8b3f011bddef
Source of Spectrum CM-1999-9082-0
Wiley ID 471436