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3H-pyrazol-3-one, 5-amino-2,4-dihydro-4-(4-methylphenoxy)-2-(4-nitrophenyl)-
SpectraBase Compound ID AZnXto1MADB
InChI InChI=1S/C16H14N4O4/c1-10-2-8-13(9-3-10)24-14-15(17)18-19(16(14)21)11-4-6-12(7-5-11)20(22)23/h2-9,14H,1H3,(H2,17,18)
InChIKey JCFDASBARKAJHU-UHFFFAOYSA-N
Mol Weight 326.31 g/mol
Molecular Formula C16H14N4O4
Exact Mass 326.101505 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EIhQso3M2gY
Name 3H-pyrazol-3-one, 5-amino-2,4-dihydro-4-(4-methylphenoxy)-2-(4-nitrophenyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N4O4
InChI InChI=1S/C16H14N4O4/c1-10-2-8-13(9-3-10)24-14-15(17)18-19(16(14)21)11-4-6-12(7-5-11)20(22)23/h2-9,14H,1H3,(H2,17,18)
InChIKey JCFDASBARKAJHU-UHFFFAOYSA-N
Molecular Weight 326.312 g/mol
SMILES NC=1C(Oc2ccc(C)cc2)C(N(N1)c1ccc(cc1)[N+]([O-])=O)=O
SPLASH splash10-014i-7791000000-760ebfc54dbbd59b67ec
Source of Spectrum JX-2015-3-418
Synonyms 3-Amino-1-(4-nitrophenyl)-4-(p-tolyloxy)-1H-pyrazol-5(4H)-one 5-Amino-4-(4-methylphenoxy)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one 5-Amino-4-(4-methylphenoxy)-2-(4-nitrophenyl)-4H-pyrazol-3-one 5-Azanyl-4-(4-methylphenoxy)-2-(4-nitrophenyl)-4H-pyrazol-3-one
Wiley ID 1723985