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5-Amino-1-cyclohexyl-6-(2-hydroxyphenyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
SpectraBase Compound ID 3XltllWWgA0
InChI InChI=1S/C20H20N4O/c21-11-13-12-24(14-6-2-1-3-7-14)20-16(13)10-17(22)19(23-20)15-8-4-5-9-18(15)25/h4-5,8-10,12,14,25H,1-3,6-7,22H2
InChIKey XNCHLUDNYIQGDW-UHFFFAOYSA-N
Mol Weight 332.41 g/mol
Molecular Formula C20H20N4O
Exact Mass 332.163711 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FlVsx3xTtm1
Name 5-Amino-1-cyclohexyl-6-(2-hydroxyphenyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N4O
InChI InChI=1S/C20H20N4O/c21-11-13-12-24(14-6-2-1-3-7-14)20-16(13)10-17(22)19(23-20)15-8-4-5-9-18(15)25/h4-5,8-10,12,14,25H,1-3,6-7,22H2
InChIKey XNCHLUDNYIQGDW-UHFFFAOYSA-N
Molecular Weight 332.407 g/mol
SMILES Nc1cc2c(c[n](c2nc1-c1c(cccc1)O)C1CCCCC1)C#N
SPLASH splash10-0ue9-0095000000-07d49265d7159765b2b7
Source of Spectrum F-68-2541-4g
Wiley ID 1708847