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(E)-5-Amino-3-methyl-1-(((4??-nitrophenyl)imino)(phenyl)methyl)-1H-pyrazole-4-carbonitrile
SpectraBase Compound ID K0iSaYu2CH8
InChI InChI=1S/C18H14N6O2/c1-12-16(11-19)17(20)23(22-12)18(13-5-3-2-4-6-13)21-14-7-9-15(10-8-14)24(25)26/h2-10H,20H2,1H3/b21-18+
InChIKey MUNLJGGZHHVADE-DYTRJAOYSA-N
Mol Weight 346.35 g/mol
Molecular Formula C18H14N6O2
Exact Mass 346.117824 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kMnovbTPM
Name (E)-5-Amino-3-methyl-1-(((4??-nitrophenyl)imino)(phenyl)methyl)-1H-pyrazole-4-carbonitrile
Appearance Pale yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14N6O2
InChI InChI=1S/C18H14N6O2/c1-12-16(11-19)17(20)23(22-12)18(13-5-3-2-4-6-13)21-14-7-9-15(10-8-14)24(25)26/h2-10H,20H2,1H3/b21-18+
InChIKey MUNLJGGZHHVADE-DYTRJAOYSA-N
Instrument Name Finnigan Mat 8430
Ionization Type EI
Literature Reference DOI 10.24820/ark.5550190.p009.877
Molecular Weight 346.350 g/mol
SMILES Nc1[n](\C(=N\c2ccc(cc2)[N+]([O-])=O)c2ccccc2)nc(c1C#N)C
SPLASH splash10-0zms-0944000000-b7977677f0170d60ba5a
Source of Spectrum ARK-2016-101-3n
Wiley ID 1840821