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4-([(E)-(4-Chlorophenyl)methylidene]amino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID 8BzKQmBgEgD
InChI InChI=1S/C18H16ClN3O/c1-13-17(20-12-14-8-10-15(19)11-9-14)18(23)22(21(13)2)16-6-4-3-5-7-16/h3-12H,1-2H3/b20-12+
InChIKey JVBNUGGDDDTNSS-UDWIEESQSA-N
Mol Weight 325.8 g/mol
Molecular Formula C18H16ClN3O
Exact Mass 325.09819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Pa8j2CdrJK
Name 4-([(E)-(4-Chlorophenyl)methylidene]amino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
CAS Registry Number 61098-04-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16ClN3O
InChI InChI=1S/C18H16ClN3O/c1-13-17(20-12-14-8-10-15(19)11-9-14)18(23)22(21(13)2)16-6-4-3-5-7-16/h3-12H,1-2H3/b20-12+
InChIKey JVBNUGGDDDTNSS-UDWIEESQSA-N
Molecular Weight 325.799 g/mol
SMILES C=1(N(N(C(C1\N=C\c1ccc(cc1)Cl)=O)c1ccccc1)C)C
SPLASH splash10-0a6r-9524000000-2313b3a92c98b4eebf97
Source of Spectrum AD-0-2532-0
Synonyms 3H-Pyrazol-3-one, 4-[[(4-chlorophenyl)methylene]amino]-1,2-dihydro-1,5-dimethyl-2-phenyl-
Wiley ID 1423241