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6-Amino-4-(3-bromo-4-fluoro-phenyl)-3-isopropyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SpectraBase Compound ID C2lntWjGnko
InChI InChI=1S/C16H14BrFN4O/c1-7(2)14-13-12(8-3-4-11(18)10(17)5-8)9(6-19)15(20)23-16(13)22-21-14/h3-5,7,12H,20H2,1-2H3,(H,21,22)
InChIKey FMYKWPCZIJPXLF-UHFFFAOYSA-N
Mol Weight 377.22 g/mol
Molecular Formula C16H14BrFN4O
Exact Mass 376.033502 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXpvaM1gB0j
Name 6-Amino-4-(3-bromo-4-fluoro-phenyl)-3-isopropyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Alternate Name(s) 6-Amino-4-(3-bromo-4-fluorophenyl)-3-propan-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile 6-Azanyl-4-(3-bromanyl-4-fluoranyl-phenyl)-3-propan-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
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Formula C16H14BrFN4O
InChI InChI=1S/C16H14BrFN4O/c1-7(2)14-13-12(8-3-4-11(18)10(17)5-8)9(6-19)15(20)23-16(13)22-21-14/h3-5,7,12H,20H2,1-2H3,(H,21,22)
InChIKey FMYKWPCZIJPXLF-UHFFFAOYSA-N
Molecular Weight 377.217 g/mol
SMILES NC1=C(C(c2c(O1)[nH]nc2C(C)C)c1cc(Br)c(cc1)F)C#N
SPLASH splash10-0udi-1491000000-f69ee6edf4f1760a089a
Wiley ID 1453341