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m-Cymene, 5-tert-butyl-
SpectraBase Compound ID JjXki7NKDiv
InChI InChI=1S/C14H22/c1-10(2)12-7-11(3)8-13(9-12)14(4,5)6/h7-10H,1-6H3
InChIKey LRXFIRUKENCJLW-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 JQtp4BsFK6u
Name m-Cymene, 5-tert-butyl-
Alternate Name(s) 1-tert-Butyl-3-isopropyl-5-methylbenzene 1-tert-Butyl-3-methyl-5-propan-2-yl-benzene 1-tert-Butyl-3-methyl-5-propan-2-ylbenzene
CAS Registry Number 29577-19-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22
InChI InChI=1S/C14H22/c1-10(2)12-7-11(3)8-13(9-12)14(4,5)6/h7-10H,1-6H3
InChIKey LRXFIRUKENCJLW-UHFFFAOYSA-N
Molecular Weight 190.330 g/mol
SMILES Cc1cc(cc(c1)C(C)(C)C)C(C)C
SPLASH splash10-004i-2900000000-5f821be1f32e6f63f5c8
Source of Spectrum AP-0-2187-0
Wiley ID 20828