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1-Sec-butyl-4-methylbenzene
SpectraBase Compound ID 9WijcD4Dy8o
InChI InChI=1S/C11H16/c1-4-10(3)11-7-5-9(2)6-8-11/h5-8,10H,4H2,1-3H3
InChIKey LWCFXYMSEGQWNB-UHFFFAOYSA-N
Mol Weight 148.25 g/mol
Molecular Formula C11H16
Exact Mass 148.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12uukLjVRg9
Name 1-Sec-butyl-4-methylbenzene
CAS Registry Number 1595-16-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16
InChI InChI=1S/C11H16/c1-4-10(3)11-7-5-9(2)6-8-11/h5-8,10H,4H2,1-3H3
InChIKey LWCFXYMSEGQWNB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200404256
Molecular Weight 148.249 g/mol
SMILES CC(CC)c1ccc(cc1)C
SPLASH splash10-014i-1900000000-0c4084c4b4919867e156
Source of Spectrum ASC-347-282/SM8-8b
Synonyms 1-Methyl-4-(1-methylpropyl)benzene 2-(4-Methylphenyl)-butane 1-Butan-2-yl-4-methyl-benzene 1-Methyl-4-sec-butyl-benzene 4-(2-Butyl)toluene Benzene, 1-methyl-4-(1-methylpropyl)- 1-Methyl-4-(1-methylpropyl)-benzene 1-Methyl-4-sec-butylbenzene 1-(sec-butyl)-4-methylbenzene 1-Butan-2-yl-4-methylbenzene
Wiley ID 1767848