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2,7-Dimethyl-8-phenylazo-3-[N-(4-chlorophenyl)-1-ethoxycarbonyl-methanehydrazonoyl]pyrazolo[1,5-a]pyrimidin-4(3H)-one
SpectraBase Compound ID IivVoTd9MP0
InChI InChI=1S/C24H22ClN7O3/c1-4-35-24(34)21(30-28-18-12-10-16(25)11-13-18)19-14(2)26-22-20(15(3)31-32(22)23(19)33)29-27-17-8-6-5-7-9-17/h5-13,19,28H,4H2,1-3H3
InChIKey FAZFZHFSSTZHIG-UHFFFAOYSA-N
Mol Weight 491.94 g/mol
Molecular Formula C24H22ClN7O3
Exact Mass 491.147265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fjPJuZzwsS
Name 2,7-Dimethyl-8-phenylazo-3-[N-(4-chlorophenyl)-1-ethoxycarbonyl-methanehydrazonoyl]pyrazolo[1,5-a]pyrimidin-4(3H)-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22ClN7O3
InChI InChI=1S/C24H22ClN7O3/c1-4-35-24(34)21(30-28-18-12-10-16(25)11-13-18)19-14(2)26-22-20(15(3)31-32(22)23(19)33)29-27-17-8-6-5-7-9-17/h5-13,19,28H,4H2,1-3H3
InChIKey FAZFZHFSSTZHIG-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-Q1000-EX or GCMS 5988-A HP
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.a16
Molecular Weight 491.939 g/mol
SMILES N(N=C(C1C(=Nc2[n](nc(c2N=Nc2ccccc2)C)C1=O)C)C(OCC)=O)c1ccc(cc1)Cl
SPLASH splash10-01tc-9403000000-1e2d2cf24b02dba783ba
Source of Spectrum ARK-2009-166-3h
Wiley ID 1869613