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Benzene, 1,2,4-trimethyl-5-(2-methyl-3-butynyl)-
SpectraBase Compound ID AzVn0a9m364
InChI InChI=1S/C14H18/c1-6-10(2)7-14-9-12(4)11(3)8-13(14)5/h1,8-10H,7H2,2-5H3
InChIKey TWVNLLYILHRMAC-UHFFFAOYSA-N
Mol Weight 186.3 g/mol
Molecular Formula C14H18
Exact Mass 186.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8gF5ResTkzw
Name Benzene, 1,2,4-trimethyl-5-(2-methyl-3-butynyl)-
Alternate Name(s) 1,2,4-trimethyl-5-(2-methyl-3-butynyl)benzene 1-(2'-Methyl-3'-butynyl)-2,4,5-trimethylbenzene
CAS Registry Number 97183-41-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18
InChI InChI=1S/C14H18/c1-6-10(2)7-14-9-12(4)11(3)8-13(14)5/h1,8-10H,7H2,2-5H3
InChIKey TWVNLLYILHRMAC-UHFFFAOYSA-N
Molecular Weight 186.298 g/mol
SMILES c1(cc(C)c(cc1C)C)CC(C#C)C
SPLASH splash10-05g0-1900000000-85da2ccbdfe5fb9b6dc3
Source of Spectrum H-68-368-39
Wiley ID 1183536