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2-Methyl-4-(3-methylphenyl)-3-butyn-2-ol
SpectraBase Compound ID Fu5DEeepIzE
InChI InChI=1S/C12H14O/c1-10-5-4-6-11(9-10)7-8-12(2,3)13/h4-6,9,13H,1-3H3
InChIKey SEUCDVKEFJTWQR-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 FuHtQ6AeLHv
Name 2-Methyl-4-(3-methylphenyl)-3-butyn-2-ol
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O
InChI InChI=1S/C12H14O/c1-10-5-4-6-11(9-10)7-8-12(2,3)13/h4-6,9,13H,1-3H3
InChIKey SEUCDVKEFJTWQR-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#Cc1cccc(c1)C)(C)C
SPLASH splash10-0a4i-0900000000-5f5711099a464fde30bb
Source of Spectrum BJO-10-SM8-2g
Wiley ID 1854103