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2-[(2E)-2-Butenyl]-1,3,5-trimethylbenzene
SpectraBase Compound ID KecqSnXYvp4
InChI InChI=1S/C13H18/c1-5-6-7-13-11(3)8-10(2)9-12(13)4/h5-6,8-9H,7H2,1-4H3/b6-5+
InChIKey IEEFGVBHKUHLGZ-AATRIKPKSA-N
Mol Weight 174.29 g/mol
Molecular Formula C13H18
Exact Mass 174.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLyShF3Smek
Name 2-[(2E)-2-Butenyl]-1,3,5-trimethylbenzene
Alternate Name(s) 2-[(E)-but-2-enyl]-1,3,5-trimethyl-benzene Benzene, 2-(2-butenyl)-1,3,5-trimethyl-
CAS Registry Number 65001-55-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18
InChI InChI=1S/C13H18/c1-5-6-7-13-11(3)8-10(2)9-12(13)4/h5-6,8-9H,7H2,1-4H3/b6-5+
InChIKey IEEFGVBHKUHLGZ-AATRIKPKSA-N
Molecular Weight 174.287 g/mol
SMILES c1(c(cc(cc1C)C)C)C\C=C\C
SPLASH splash10-0ab9-0900000000-14a00567066e5effb8f3
Source of Spectrum H-60-2055-0
Wiley ID 1171130