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Ethyl 2-(2-phenylhydrazono)-2-(1,2,3,4-tetrahydro-4-oxo-5-phenyl-2-thioxopyrido[2,3-d]pyrimidin-7-yl)acetate
SpectraBase Compound ID DBrAcB4JdcL
InChI InChI=1S/C23H19N5O3S/c1-2-31-22(30)19(28-27-15-11-7-4-8-12-15)17-13-16(14-9-5-3-6-10-14)18-20(24-17)25-23(32)26-21(18)29/h3-13,27H,2H2,1H3,(H2,24,25,26,29,32)
InChIKey QHJLPGCMUQCRID-UHFFFAOYSA-N
Mol Weight 445.5 g/mol
Molecular Formula C23H19N5O3S
Exact Mass 445.120861 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uWnkb8oZk
Name Ethyl 2-(2-phenylhydrazono)-2-(1,2,3,4-tetrahydro-4-oxo-5-phenyl-2-thioxopyrido[2,3-d]pyrimidin-7-yl)acetate
Appearance Brown solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H19N5O3S
InChI InChI=1S/C23H19N5O3S/c1-2-31-22(30)19(28-27-15-11-7-4-8-12-15)17-13-16(14-9-5-3-6-10-14)18-20(24-17)25-23(32)26-21(18)29/h3-13,27H,2H2,1H3,(H2,24,25,26,29,32)
InChIKey QHJLPGCMUQCRID-UHFFFAOYSA-N
Instrument Name Shimadzu Qp-2010 Plus
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3901
Molecular Weight 445.497 g/mol
SMILES N1C(NC(c2c(cc(C(C(OCC)=O)=NNc3ccccc3)nc12)-c1ccccc1)=O)=S
SPLASH splash10-066u-9300000000-afd9c7fbe7a40347034a
Source of Spectrum Y-57-SM5-8a
Wiley ID 1860153