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1-Cinnamyl-2-(hept-1-ynyl)benzene

View entire compound with spectra: 1 MS (GC)

1-Cinnamyl-2-(hept-1-ynyl)benzene
SpectraBase Compound ID B2HX2L8P0Le
InChI InChI=1S/C22H24/c1-2-3-4-5-9-16-21-17-10-11-18-22(21)19-12-15-20-13-7-6-8-14-20/h6-8,10-15,17-18H,2-5,19H2,1H3/b15-12+
InChIKey XVXCCCZNUNPXNS-NTCAYCPXSA-N
Mol Weight 288.43 g/mol
Molecular Formula C22H24
Exact Mass 288.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91RSyrUElJv
Name 1-Cinnamyl-2-(hept-1-ynyl)benzene
Alternate Name(s) 1-Cinnamyl-2-(hept-1-yn-1-yl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24
InChI InChI=1S/C22H24/c1-2-3-4-5-9-16-21-17-10-11-18-22(21)19-12-15-20-13-7-6-8-14-20/h6-8,10-15,17-18H,2-5,19H2,1H3/b15-12+
InChIKey XVXCCCZNUNPXNS-NTCAYCPXSA-N
Literature Reference DOI 10.1021/ol900643r
Molecular Weight 288.434 g/mol
SMILES c1cc(C\C=C\c2ccccc2)c(cc1)C#CCCCCC
SPLASH splash10-014i-1190000000-11bf619eae32f945f9d9
Source of Spectrum A1-11-2309/SMS8-18
Wiley ID 1756791