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Oxyphenbutazone isomer-1 2ME         @
SpectraBase Compound ID L3OpTb3DKkh
InChI InChI=1S/C21H24N2O3/c1-4-5-11-19-20(24)22(17-12-14-18(25-2)15-13-17)23(21(19)26-3)16-9-7-6-8-10-16/h6-10,12-15H,4-5,11H2,1-3H3
InChIKey VYUGZVZVMDXOCG-UHFFFAOYSA-N
Mol Weight 352.43 g/mol
Molecular Formula C21H24N2O3
Exact Mass 352.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 23BbzdhKbSv
Name 4-Butyl-5-methoxy-2-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-3(2H)-one
Alternate Name(s) 4-Butyl-5-methoxy-2-(4-methoxyphenyl)-1-phenyl-1,2-dihydro-3H-pyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24N2O3
InChI InChI=1S/C21H24N2O3/c1-4-5-11-19-20(24)22(17-12-14-18(25-2)15-13-17)23(21(19)26-3)16-9-7-6-8-10-16/h6-10,12-15H,4-5,11H2,1-3H3
InChIKey VYUGZVZVMDXOCG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.19723050504
Molecular Weight 352.434 g/mol
SMILES C1(=C(N(N(C1=O)c1ccc(cc1)OC)c1ccccc1)OC)CCCC
SPLASH splash10-0ufr-2925000000-6936843339b55dd83dc7
Source of Spectrum APC-305-337-6
Wiley ID 1787693