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1-(4-Methylcoumarinyl-7-oxyacetyl)-3,5-dimethyl-4-(4-chlorophenylazo)pyrazole
SpectraBase Compound ID CiNKVfiW5w4
InChI InChI=1S/C23H19ClN4O4/c1-13-10-22(30)32-20-11-18(8-9-19(13)20)31-12-21(29)28-15(3)23(14(2)27-28)26-25-17-6-4-16(24)5-7-17/h4-11H,12H2,1-3H3/b26-25+
InChIKey GUNHSNKZUMAULR-OCEACIFDSA-N
Mol Weight 450.88 g/mol
Molecular Formula C23H19ClN4O4
Exact Mass 450.109483 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3aJuiuTWCiD
Name 1-(4-Methylcoumarinyl-7-oxyacetyl)-3,5-dimethyl-4-(4-chlorophenylazo)pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H19ClN4O4
InChI InChI=1S/C23H19ClN4O4/c1-13-10-22(30)32-20-11-18(8-9-19(13)20)31-12-21(29)28-15(3)23(14(2)27-28)26-25-17-6-4-16(24)5-7-17/h4-11H,12H2,1-3H3/b26-25+
InChIKey GUNHSNKZUMAULR-OCEACIFDSA-N
Molecular Weight 450.882 g/mol
SMILES c1([n](nc(c1\N=N\c1ccc(cc1)Cl)C)C(COc1cc2OC(=O)C=C(c2cc1)C)=O)C
SPLASH splash10-00dj-0960200000-aa71f3b66b9ab8050e45
Source of Spectrum F2-44-4693-3d
Wiley ID 1705731