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2-methyl-4-(p-tolyl)butan-2-ol
SpectraBase Compound ID J9Fyciw5dxM
InChI InChI=1S/C12H18O/c1-10-4-6-11(7-5-10)8-9-12(2,3)13/h4-7,13H,8-9H2,1-3H3
InChIKey SESJVQRKRIBXEX-UHFFFAOYSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HeDdQSJsPUa
Name 2-methyl-4-(p-tolyl)butan-2-ol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 178.135765199 u
Formula C12H18O
InChI InChI=1S/C12H18O/c1-10-4-6-11(7-5-10)8-9-12(2,3)13/h4-7,13H,8-9H2,1-3H3
InChIKey SESJVQRKRIBXEX-UHFFFAOYSA-N
Instrument Name Finnigan MAT95Q or Finnigan MAT90
Ionization Type EI
Literature Reference DOI 10.1002/anie.202203807
Molecular Weight 178.275 g/mol
Quality 163
Reported Formula C12H18O
SMILES OC(CCC1=CC=C(C=C1)C)(C)C
SPLASH splash10-052b-0900000000-f04c898dab27a73123c9
Source of Spectrum ACI-61-SM30-10e (DOI: 10.1002/anie.202203807)
Wiley ID 1897795