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1-(4-Methoxyphenylethynyl)-4-(4-n-pentylcyclohexyl)benzene
SpectraBase Compound ID EBUIToiDlz5
InChI InChI=1S/C26H32O/c1-3-4-5-6-21-9-15-24(16-10-21)25-17-11-22(12-18-25)7-8-23-13-19-26(27-2)20-14-23/h11-14,17-21,24H,3-6,9-10,15-16H2,1-2H3
InChIKey XCMYRYNJLWEIGL-UHFFFAOYSA-N
Mol Weight 360.5 g/mol
Molecular Formula C26H32O
Exact Mass 360.245316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GOXBDqu7d3C
Name 1-(4-Methoxyphenylethynyl)-4-(4-n-pentylcyclohexyl)benzene
Alternate Name(s) 1-Methoxy-4-((4-(4-pentylcyclohexyl)phenyl)ethynyl)benzene 1-Methoxy-4-[2-[4-(4-pentylcyclohexyl)phenyl]ethynyl]benzene
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Formula C26H32O
InChI InChI=1S/C26H32O/c1-3-4-5-6-21-9-15-24(16-10-21)25-17-11-22(12-18-25)7-8-23-13-19-26(27-2)20-14-23/h11-14,17-21,24H,3-6,9-10,15-16H2,1-2H3
InChIKey XCMYRYNJLWEIGL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/aoc.1642
Molecular Weight 360.541 g/mol
SMILES C1C(CCC(c2ccc(C#Cc3ccc(cc3)OC)cc2)C1)CCCCC
SPLASH splash10-0bt9-1296000000-bdff33a7f415598136b1
Source of Spectrum AOC-24-n/a/SM3-3b
Wiley ID 1768503