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(E/Z)-3-(4-Cyanophenyl)imino-1-oxo-2-phenyl-1,2,3,5,6,7-hexahydropyrrolo[1,2-c]pyrimidine-4-carbonitrile
SpectraBase Compound ID Mmg8GkRTUu
InChI InChI=1S/C21H15N5O/c22-13-15-8-10-16(11-9-15)24-20-18(14-23)19-7-4-12-25(19)21(27)26(20)17-5-2-1-3-6-17/h1-3,5-6,8-11H,4,7,12H2/b24-20+
InChIKey TZYJHICTQLZHKW-HIXSDJFHSA-N
Mol Weight 353.39 g/mol
Molecular Formula C21H15N5O
Exact Mass 353.12766 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A97poYeBMyc
Name (E/Z)-3-(4-Cyanophenyl)imino-1-oxo-2-phenyl-1,2,3,5,6,7-hexahydropyrrolo[1,2-c]pyrimidine-4-carbonitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15N5O
InChI InChI=1S/C21H15N5O/c22-13-15-8-10-16(11-9-15)24-20-18(14-23)19-7-4-12-25(19)21(27)26(20)17-5-2-1-3-6-17/h1-3,5-6,8-11H,4,7,12H2/b24-20+
InChIKey TZYJHICTQLZHKW-HIXSDJFHSA-N
Molecular Weight 353.385 g/mol
SMILES C1(N(\C(C(=C2CCCN12)C#N)=N/c1ccc(C#N)cc1)c1ccccc1)=O
SPLASH splash10-014i-0091000000-efb511891622bad84bf8
Source of Spectrum F2-44-4579-3f
Wiley ID 1705785