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Dichloralphenazone
SpectraBase Compound ID KEm3mjCwokg
InChI InChI=1S/C11H12N2O.2C2H3Cl3O2/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10;2*3-2(4,5)1(6)7/h3-8H,1-2H3;2*1,6-7H
InChIKey ATKXDQOHNICLQW-UHFFFAOYSA-N
Mol Weight 519.04 g/mol
Molecular Formula C15H18Cl6N2O5
Exact Mass 515.934688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IjtYiUnYpui
Name Dichloralphenazone
Alternate Name(s) 1,2-Dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one, compd. with 2,2,2-trichloro-1,1-ethanediol (1:2) 1,2-Dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one, compound with 2,2,2-trichloroethane-1,1-diol (1:2) 1,5-Dimethyl-2-phenyl-pyrazol-3-one; 2,2,2-trichloroethane-1,1-diol 3H-pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-2-phenyl-, compd. with 2,2,2-trichloro-1,1-ethanediol (1:2) Antipyrine, compd. with chloral hydrate (1:2) Antipyrine, compound with chloral hydrate (1:2) Dichloralantipyrin Dichloralantipyrine Dormuphar Ibiodorm Kloralfenazon SEDOR Sominat Welldorm 1,5-Dimethyl-2-phenyl-3-pyrazolone;2,2,2-trichloroethane-1,1-diol 1,5-Dimethyl-2-phenylpyrazol-3-one;2,2,2-trichloroethane-1,1-diol 1,5-Dimethyl-2-phenyl-pyrazol-3-one;2,2,2-trichloroethane-1,1-diol 1,5-Dimethyl-2-phenyl-pyrazol-3-one;2,2,2-tris(chloranyl)ethane-1,1-diol EINECS 207-546-0
CAS Registry Number 480-30-8
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Formula C15H18Cl6N2O5
InChI InChI=1S/C11H12N2O.2C2H3Cl3O2/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10;2*3-2(4,5)1(6)7/h3-8H,1-2H3;2*1,6-7H
InChIKey ATKXDQOHNICLQW-UHFFFAOYSA-N
Molecular Weight 519.036 g/mol
SMILES OC(C(Cl)(Cl)Cl)O.C1(N(N(C)C(=C1)C)c1ccccc1)=O.OC(C(Cl)(Cl)Cl)O
SPLASH splash10-001s-9400000000-c5d7437100d8f1ae56d1
Source of Spectrum JZ-1992-1562-0
Wiley ID 1401327