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(E)-2,2'-(Prop-1-ene-1,3-diyl)bis(methylbenzene)
SpectraBase Compound ID 3apKhu6cy1A
InChI InChI=1S/C17H18/c1-14-8-3-5-10-16(14)12-7-13-17-11-6-4-9-15(17)2/h3-12H,13H2,1-2H3/b12-7+
InChIKey DCEIPVCDUCMETR-KPKJPENVSA-N
Mol Weight 222.33 g/mol
Molecular Formula C17H18
Exact Mass 222.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtbIqwtp4GK
Name (E)-2,2'-(Prop-1-ene-1,3-diyl)bis(methylbenzene)
Alternate Name(s) 1-Methyl-2-[(E)-3-(2-methylphenyl)prop-1-enyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18
InChI InChI=1S/C17H18/c1-14-8-3-5-10-16(14)12-7-13-17-11-6-4-9-15(17)2/h3-12H,13H2,1-2H3/b12-7+
InChIKey DCEIPVCDUCMETR-KPKJPENVSA-N
Literature Reference DOI 10.1021/ol1031552
Molecular Weight 222.331 g/mol
SMILES c1ccc(C\C=C\c2c(cccc2)C)c(c1)C
SPLASH splash10-0v59-0930000000-1cc1e3853620f126a376
Source of Spectrum A1-13-1126/SMS4-7
Wiley ID 1752846