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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 LuvrJLuoS5L
Name 1-Phenyl-2-(4-methoxyphenyl)4-butyl-5-methoxy-2,3-dihydropyrazol-3-one
Alternate Name(s) 4-Butyl-3-methoxy-1-(4-methoxyphenyl)-2-phenyl-1,2-dihydro-3H-pyrazol-5-one 4-Butyl-5-methoxy-2-(4-methoxyphenyl)-1-phenyl-1,2-dihydro-3H-pyrazol-3-one Oxphenbutazone di-methyl derivative
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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
Molecular Weight 352.434 g/mol
SMILES C1(N(N(C(=C1CCCC)OC)c1ccccc1)c1ccc(cc1)OC)=O
SPLASH splash10-0udi-2129000000-dad19bde5e062886a14f
Source of Spectrum CJ-1992-0-0
Wiley ID 1343441