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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 Lkm6DbSyxrC
Name 1-Butan-2-yl-2-ethyl-benzene
CAS Registry Number 28654-79-7
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
Molecular Weight 162.276 g/mol
SMILES c1(c(CC)cccc1)C(CC)C
SPLASH splash10-0002-1900000000-dadea9b1eb88b35e4ab0
Source of Spectrum JX-2015-6-9388
Synonyms 1-Ethyl-2-sec-butyl-benzene AR-tert-butyl-aR-ethylbenzene 1-(sec-butyl)-2-ethylbenzene 1-Butan-2-yl-2-ethylbenzene
Wiley ID 1730271