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3H-Pyrazol-3-one, 4-[[4-(dimethylamino)phenyl]imino]-2,4-dihydro-5-methyl-2-(4-nitrophenyl)-
SpectraBase Compound ID 4rhiU1IJTxk
InChI InChI=1S/C18H17N5O3/c1-12-17(19-13-4-6-14(7-5-13)21(2)3)18(24)22(20-12)15-8-10-16(11-9-15)23(25)26/h4-11H,1-3H3/b19-17+
InChIKey MPKFWAXELVGYIY-HTXNQAPBSA-N
Mol Weight 351.37 g/mol
Molecular Formula C18H17N5O3
Exact Mass 351.133139 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I9qWjAWdYRT
Name 3H-Pyrazol-3-one, 4-[[4-(dimethylamino)phenyl]imino]-2,4-dihydro-5-methyl-2-(4-nitrophenyl)-
Alternate Name(s) (4E)-4-([4-(Dimethylamino)phenyl]imino)-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one 2-Pyrazolin-5-one, 4-[[p-(dimethylamino)phenyl]imino]-3-methyl-1-(p-nitrophenyl)- (E)-4-((4-(dimethylamino)phenyl)imino)-3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5(4H)-one
CAS Registry Number 27808-02-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17N5O3
InChI InChI=1S/C18H17N5O3/c1-12-17(19-13-4-6-14(7-5-13)21(2)3)18(24)22(20-12)15-8-10-16(11-9-15)23(25)26/h4-11H,1-3H3/b19-17+
InChIKey MPKFWAXELVGYIY-HTXNQAPBSA-N
Molecular Weight 351.366 g/mol
SMILES CN(C)c1ccc(cc1)\N=C/1C(C)=NN(c2ccc(cc2)N(=O)=O)C1=O
SPLASH splash10-0udi-5839000000-ca3352607d74db932132
Source of Spectrum EP-4390-0-0
Wiley ID 1342539