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1-Butan-2-yl-2-ethyl-benzene
SpectraBase Compound ID AKerot9sBT8
InChI InChI=1S/C12H18/c1-4-10(3)12-9-7-6-8-11(12)5-2/h6-10H,4-5H2,1-3H3
InChIKey MLXMBIUVXPMUPK-UHFFFAOYSA-N
Mol Weight 162.28 g/mol
Molecular Formula C12H18
Exact Mass 162.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSgoFZ4ijoC
Name 1-sec-Butyl-2-ethylbenzene
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18
InChI InChI=1S/C12H18/c1-4-10(3)12-9-7-6-8-11(12)5-2/h6-10H,4-5H2,1-3H3
InChIKey MLXMBIUVXPMUPK-UHFFFAOYSA-N
Instrument Name HP 5995C
Ionization Type EI
Literature Reference DOI 10.1002/anie.201812537
Molecular Weight 162.276 g/mol
Reported Formula C12H18
SMILES c1ccc(c(c1)C(C)CC)CC
SPLASH splash10-001i-1900000000-deb36f6bd8abfac95517
Source of Spectrum ACI-58-SM19-2jb
Wiley ID 1840611