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3-[1,1-DIMETHYLPROPYNYL]-QUINAZOLIN-4-(3-H)-ONE
SpectraBase Compound ID GA673F8fqPi
InChI InChI=1S/C13H12N2O/c1-4-13(2,3)15-9-14-11-8-6-5-7-10(11)12(15)16/h1,5-9H,2-3H3
InChIKey YXVFFUKQXMMEOO-UHFFFAOYSA-N
Mol Weight 212.25 g/mol
Molecular Formula C13H12N2O
Exact Mass 212.094963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JeGcOJKlJOl
Name 3-(1,1-dimethylprop-2-ynyl)quinazolin-4-one
CAS Registry Number 132782-94-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O
InChI InChI=1S/C13H12N2O/c1-4-13(2,3)15-9-14-11-8-6-5-7-10(11)12(15)16/h1,5-9H,2-3H3
InChIKey YXVFFUKQXMMEOO-UHFFFAOYSA-N
Molecular Weight 212.252 g/mol
SMILES C1(N(C=Nc2ccccc12)C(C#C)(C)C)=O
SPLASH splash10-0292-2930000000-0cf0ef55567b0f2371cd
Source of Spectrum Y-27-1954-2
Synonyms 3-(1,1-Dimethylprop-2-ynyl)-quinazolin-4(3H)-one 3-(2-Methylbut-3-yn-2-yl)-4-quinazolinone 3-(2-Methylbut-3-yn-2-yl)quinazolin-4-one 3-(2-Methylbut-3-yn-2-yl)quinazolin-4(3H)-one
Wiley ID 1211737