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2-Isopentyl-1,3,4-trimethylbenzene
SpectraBase Compound ID KdMwihxQoG1
InChI InChI=1S/C14H22/c1-10(2)6-9-14-12(4)8-7-11(3)13(14)5/h7-8,10H,6,9H2,1-5H3
InChIKey CBOJILOICAVSDI-UHFFFAOYSA-N
Mol Weight 190.33 g/mol
Molecular Formula C14H22
Exact Mass 190.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AiPLsiDPdVn
Name 2-Isopentyl-1,3,4-trimethylbenzene
CAS Registry Number 84651-14-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22
InChI InChI=1S/C14H22/c1-10(2)6-9-14-12(4)8-7-11(3)13(14)5/h7-8,10H,6,9H2,1-5H3
InChIKey CBOJILOICAVSDI-UHFFFAOYSA-N
Molecular Weight 190.330 g/mol
SMILES Cc1ccc(C)c(CCC(C)C)c1C
SPLASH splash10-001i-0900000000-285336ed969461153192
Source of Spectrum O-23-43-0
Synonyms 1,2,4-trimethyl-3-(3-methylbutyl)benzene 1-(3-Methylbutyl)-2,3,6-trimethylbenzene 2-isoamyl-1,3,4-trimethyl-benzene
Wiley ID 1187216