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2-Methyl-4-(4-methylphenyl)-3-butyn-2-ol
SpectraBase Compound ID Lm7aFowWhCo
InChI InChI=1S/C12H14O/c1-10-4-6-11(7-5-10)8-9-12(2,3)13/h4-7,13H,1-3H3
InChIKey WGEOZUVLHXNJKB-UHFFFAOYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4s1UbyThDp1
Name 2-Methyl-4-(4-methylphenyl)-3-butyn-2-ol
Appearance Pale yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O
InChI InChI=1S/C12H14O/c1-10-4-6-11(7-5-10)8-9-12(2,3)13/h4-7,13H,1-3H3
InChIKey WGEOZUVLHXNJKB-UHFFFAOYSA-N
Instrument Name Thermoquest Trace GC-MS 2000
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.36
Molecular Weight 174.243 g/mol
SMILES OC(C#Cc1ccc(cc1)C)(C)C
SPLASH splash10-0a4i-0900000000-46fdbb28e3c5f3c00721
Source of Spectrum BJO-10-SM9-2h
Wiley ID 1854104