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2-Amno-N'-[(4-chlorophenyl)methylidene]-5-cyano-8-methyl-6-oxo-6H-1-benzoxocine-3-carbohydrazide
SpectraBase Compound ID 1EUh7s8pQvG
InChI InChI=1S/C21H15ClN4O3/c1-12-2-7-18-16(8-12)19(27)14(10-23)9-17(20(24)29-18)21(28)26-25-11-13-3-5-15(22)6-4-13/h2-9,11H,24H2,1H3,(H,26,28)/b14-9-,20-17+,25-11?
InChIKey ZTMMVJAAOFKBNI-QXUYMFBLSA-N
Mol Weight 406.83 g/mol
Molecular Formula C21H15ClN4O3
Exact Mass 406.083268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GuRMehbRCqD
Name 2-Amno-N'-[(4-chlorophenyl)methylidene]-5-cyano-8-methyl-6-oxo-6H-1-benzoxocine-3-carbohydrazide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15ClN4O3
InChI InChI=1S/C21H15ClN4O3/c1-12-2-7-18-16(8-12)19(27)14(10-23)9-17(20(24)29-18)21(28)26-25-11-13-3-5-15(22)6-4-13/h2-9,11H,24H2,1H3,(H,26,28)/b14-9-,20-17+,25-11?
InChIKey ZTMMVJAAOFKBNI-QXUYMFBLSA-N
Literature Reference DOI 10.1007/s10593-014-1632-y
Molecular Weight 406.829 g/mol
SMILES N(C(\C1=C\(Oc2ccc(cc2C(\C(=C/1)C#N)=O)C)N)=O)N=Cc1ccc(cc1)Cl
SPLASH splash10-0udi-4390100000-a91dfed0c94ab74b466c
Source of Spectrum HC-50-1631-11
Synonyms (2E,4Z)-2-amino-N'-(4-chlorobenzylidene)-5-cyano-8-methyl-6-oxo-6H-benzo[b]oxocine-3-carbohydrazide
Wiley ID 1800742