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1H-Pyrazole-4-carbonitrile, 5-[[(3,5-dichloro-2-hydroxyphenyl)methyl]amino]-
SpectraBase Compound ID GSqFOnzsRQg
InChI InChI=1S/C11H8Cl2N4O/c12-8-1-6(10(18)9(13)2-8)4-15-11-7(3-14)5-16-17-11/h1-2,5,18H,4H2,(H2,15,16,17)
InChIKey KRHSRCAPAXLQTN-UHFFFAOYSA-N
Mol Weight 283.12 g/mol
Molecular Formula C11H8Cl2N4O
Exact Mass 282.007516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AxQHz01GZWf
Name 1H-Pyrazole-4-carbonitrile, 5-[[(3,5-dichloro-2-hydroxyphenyl)methyl]amino]-
Alternate Name(s) 5-[(3,5-dichloro-2-hydroxyphenyl)methylamino]-1H-pyrazole-4-carbonitrile 5-[(3,5-dichloro-2-hydroxy-phenyl)methylamino]-1H-pyrazole-4-carbonitrile 5-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]methylamino]-1H-pyrazole-4-carbonitrile
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Formula C11H8Cl2N4O
InChI InChI=1S/C11H8Cl2N4O/c12-8-1-6(10(18)9(13)2-8)4-15-11-7(3-14)5-16-17-11/h1-2,5,18H,4H2,(H2,15,16,17)
InChIKey KRHSRCAPAXLQTN-UHFFFAOYSA-N
Molecular Weight 283.118 g/mol
SMILES [nH]1c(c(cn1)C#N)NCc1c(c(cc(c1)Cl)Cl)O
SPLASH splash10-0a7i-3920000000-c91927b8ebbe6afd9452
Source of Spectrum IY-1-4522-4
Wiley ID 1653207