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5-{[(3-(1H-Indol-3-yl)-1H-pyrazol-5-yl)-amino]-methylene}-1,3-dimethyl-pyrimidine-2,4,6 (1H,3H,5H)-trione
SpectraBase Compound ID Hgay2qAjlam
InChI InChI=1S/C18H16N6O3/c1-23-16(25)12(17(26)24(2)18(23)27)9-20-15-7-14(21-22-15)11-8-19-13-6-4-3-5-10(11)13/h3-9,19H,1-2H3,(H2,20,21,22)
InChIKey XQTBNWDPCGPOQC-UHFFFAOYSA-N
Mol Weight 364.37 g/mol
Molecular Formula C18H16N6O3
Exact Mass 364.128388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FeDGPWFB4ns
Name 5-{[(3-(1H-Indol-3-yl)-1H-pyrazol-5-yl)-amino]-methylene}-1,3-dimethyl-pyrimidine-2,4,6 (1H,3H,5H)-trione
Appearance Brown crystals
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Formula C18H16N6O3
InChI InChI=1S/C18H16N6O3/c1-23-16(25)12(17(26)24(2)18(23)27)9-20-15-7-14(21-22-15)11-8-19-13-6-4-3-5-10(11)13/h3-9,19H,1-2H3,(H2,20,21,22)
InChIKey XQTBNWDPCGPOQC-UHFFFAOYSA-N
Instrument Name Finnegan MAT 212
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2654
Molecular Weight 364.365 g/mol
SMILES [nH]1cc(-c2cc([nH]n2)NC=C2C(N(C(N(C2=O)C)=O)C)=O)c2ccccc12
SPLASH splash10-03xs-6902000000-3e8361782b344671f518
Source of Spectrum Y-54-920-11
Wiley ID 1877974