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2-Methyl-4-(3-acetylaminophenyl)-3-butyn-2-ol
SpectraBase Compound ID Io3MIrz3Hrh
InChI InChI=1S/C13H15NO2/c1-10(15)14-12-6-4-5-11(9-12)7-8-13(2,3)16/h4-6,9,16H,1-3H3,(H,14,15)
InChIKey SBWVSNMLPDYEOD-UHFFFAOYSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kd4J59o2rXX
Name 2-Methyl-4-(3-acetylaminophenyl)-3-butyn-2-ol
Appearance Pale yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-10(15)14-12-6-4-5-11(9-12)7-8-13(2,3)16/h4-6,9,16H,1-3H3,(H,14,15)
InChIKey SBWVSNMLPDYEOD-UHFFFAOYSA-N
Instrument Name Thermoquest Trace GC-MS 2000
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.36
Molecular Weight 217.268 g/mol
SMILES N(c1cc(C#CC(C)(O)C)ccc1)C(C)=O
SPLASH splash10-066s-0930000000-f30526ea68d185fb8906
Source of Spectrum BJO-10-SM6-2b
Wiley ID 1854099