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2-( N-Methyl- N -phenylamino)-3-phenyl-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID EtNXk0fiQEd
InChI InChI=1S/C21H19N3OS/c1-14-15(2)26-19-18(14)20(25)24(17-12-8-5-9-13-17)21(22-19)23(3)16-10-6-4-7-11-16/h4-13H,1-3H3
InChIKey XHBGCQQZYWTUJM-UHFFFAOYSA-N
Mol Weight 361.46 g/mol
Molecular Formula C21H19N3OS
Exact Mass 361.124883 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2KQPcKG4PXP
Name 2-( N-Methyl- N -phenylamino)-3-phenyl-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one
Appearance White crystals
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Formula C21H19N3OS
InChI InChI=1S/C21H19N3OS/c1-14-15(2)26-19-18(14)20(25)24(17-12-8-5-9-13-17)21(22-19)23(3)16-10-6-4-7-11-16/h4-13H,1-3H3
InChIKey XHBGCQQZYWTUJM-UHFFFAOYSA-N
Instrument Name Finnigan Trace
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.4.49
Molecular Weight 361.463 g/mol
SMILES CN(C=1N(C(c2c(N1)sc(c2C)C)=O)c1ccccc1)c1ccccc1
SPLASH splash10-03fr-6009000000-75f26fd8a55cc3470fb8
Source of Spectrum BJO-4-5-6e
Wiley ID 1871509