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2-[6-Amino-1-(4-hydroxyphenyl)-2-phenyl-2-(phenyl-amino)-2,3-dihydropyrimidine-4(1H)-ylidene]malononitrile
SpectraBase Compound ID JyTOnUNgdBG
InChI InChI=1S/C25H20N6O/c26-16-18(17-27)23-15-24(28)31(21-11-13-22(32)14-12-21)25(30-23,19-7-3-1-4-8-19)29-20-9-5-2-6-10-20/h1-15,29-30,32H,28H2
InChIKey QUOBJRDLSAQEEF-UHFFFAOYSA-N
Mol Weight 420.48 g/mol
Molecular Formula C25H20N6O
Exact Mass 420.169859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hbew3YMnd20
Name 2-[6-Amino-1-(4-hydroxyphenyl)-2-phenyl-2-(phenyl-amino)-2,3-dihydropyrimidine-4(1H)-ylidene]malononitrile
Appearance Yellowish green crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20N6O
InChI InChI=1S/C25H20N6O/c26-16-18(17-27)23-15-24(28)31(21-11-13-22(32)14-12-21)25(30-23,19-7-3-1-4-8-19)29-20-9-5-2-6-10-20/h1-15,29-30,32H,28H2
InChIKey QUOBJRDLSAQEEF-UHFFFAOYSA-N
Instrument Name JEOL JMS-600
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2510
Molecular Weight 420.476 g/mol
SMILES N1C(C=C(N(c2ccc(cc2)O)C1(Nc1ccccc1)c1ccccc1)N)=C(C#N)C#N
SPLASH splash10-03kc-2911200000-faf4a4c20d64b146d1cf
Source of Spectrum Y-53-1943-6b
Wiley ID 1876715