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1-Cyclohexyl-4-(difluoromethyl)-6-methyl-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
SpectraBase Compound ID 2cv03wguGBO
InChI InChI=1S/C16H17F2N3/c1-10-7-13(15(17)18)14-11(8-19)9-21(16(14)20-10)12-5-3-2-4-6-12/h7,9,12,15H,2-6H2,1H3
InChIKey BXOOWVOVZDSFTK-UHFFFAOYSA-N
Mol Weight 289.33 g/mol
Molecular Formula C16H17F2N3
Exact Mass 289.139054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ceKpkCi1KV
Name 1-Cyclohexyl-4-(difluoromethyl)-6-methyl-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C16H17F2N3
InChI InChI=1S/C16H17F2N3/c1-10-7-13(15(17)18)14-11(8-19)9-21(16(14)20-10)12-5-3-2-4-6-12/h7,9,12,15H,2-6H2,1H3
InChIKey BXOOWVOVZDSFTK-UHFFFAOYSA-N
Molecular Weight 289.330 g/mol
SMILES c12[n](cc(c2c(C(F)F)cc(n1)C)C#N)C1CCCCC1
SPLASH splash10-0a4i-0090000000-dd913ab4fe153cfb2ecc
Source of Spectrum F-67-5671-12d
Synonyms 1-cyclohexyl-4-(difluoromethyl)-6-methyl-3-pyrrolo[2,3-b]pyridinecarbonitrile 1-cyclohexyl-4-(difluoromethyl)-6-methylpyrrolo[2,3-b]pyridine-3-carbonitrile 4-[bis(fluoranyl)methyl]-1-cyclohexyl-6-methyl-pyrrolo[2,3-b]pyridine-3-carbonitrile
Wiley ID 1687217