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1,2,5-trimethyl-3-(3-methylbutyl)benzene
SpectraBase Compound ID BlpYSxKXFhz
InChI InChI=1S/C14H22/c1-10(2)6-7-14-9-11(3)8-12(4)13(14)5/h8-10H,6-7H2,1-5H3
InChIKey DJVPGVSCTKOSIK-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 BSI5REvaSqR
Name 1,2,5-trimethyl-3-(3-methylbutyl)benzene
Alternate Name(s) 1-(3-Methylbutyl)-2,3,5-trimethylbenzene 1-isoamyl-2,3,5-trimethyl-benzene 1-isopentyl-2,3,5-trimethyl-benzene
CAS Registry Number 107997-60-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22
InChI InChI=1S/C14H22/c1-10(2)6-7-14-9-11(3)8-12(4)13(14)5/h8-10H,6-7H2,1-5H3
InChIKey DJVPGVSCTKOSIK-UHFFFAOYSA-N
Molecular Weight 190.330 g/mol
SMILES Cc1cc(C)c(C)c(c1)CCC(C)C
SPLASH splash10-001l-0900000000-ff5e10e94d0a7b177ce6
Source of Spectrum O-23-43-0
Wiley ID 1187212