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4-[(2-hydroxy-5-nitro-benzylidene)-amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-pyrazol-3-one
SpectraBase Compound ID CdshesrX0uB
InChI InChI=1S/C18H16N4O4/c1-12-17(18(24)21(20(12)2)14-6-4-3-5-7-14)19-11-13-10-15(22(25)26)8-9-16(13)23/h3-11,23H,1-2H3/b19-11+
InChIKey ISXDJZQOYQPQED-YBFXNURJSA-N
Mol Weight 352.35 g/mol
Molecular Formula C18H16N4O4
Exact Mass 352.117155 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 89w4IBe81pO
Name 4-[(2-hydroxy-5-nitro-benzylidene)-amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-pyrazol-3-one
Alternate Name(s) 4-{[(2-hydroxy-5-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one 4-{[(E)-(2-hydroxy-5-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N4O4
InChI InChI=1S/C18H16N4O4/c1-12-17(18(24)21(20(12)2)14-6-4-3-5-7-14)19-11-13-10-15(22(25)26)8-9-16(13)23/h3-11,23H,1-2H3/b19-11+
InChIKey ISXDJZQOYQPQED-YBFXNURJSA-N
Molecular Weight 352.350 g/mol
SMILES Oc1c(cc(cc1)N(=O)=O)\C=N\C=1C(N(N(C1C)C)c1ccccc1)=O
SPLASH splash10-0zfr-9744000000-b6dab56f0560d649c0a8
Wiley ID 1452999