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6-n-butylamino-1-benzyl-4-methyl-5-cyano-7-azaindole
SpectraBase Compound ID 9YbVcK0Jd8k
InChI InChI=1S/C20H22N4/c1-3-4-11-22-19-18(13-21)15(2)17-10-12-24(20(17)23-19)14-16-8-6-5-7-9-16/h5-10,12H,3-4,11,14H2,1-2H3,(H,22,23)
InChIKey UFLBSNIJDLXDDT-UHFFFAOYSA-N
Mol Weight 318.42 g/mol
Molecular Formula C20H22N4
Exact Mass 318.184447 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D0kMJtwYAIs
Name 6-n-butylamino-1-benzyl-4-methyl-5-cyano-7-azaindole
Alternate Name(s) 1-Benzyl-6-(butylamino)-4-methyl-1H-pyrrolo[2,3-b]pyridine-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N4
InChI InChI=1S/C20H22N4/c1-3-4-11-22-19-18(13-21)15(2)17-10-12-24(20(17)23-19)14-16-8-6-5-7-9-16/h5-10,12H,3-4,11,14H2,1-2H3,(H,22,23)
InChIKey UFLBSNIJDLXDDT-UHFFFAOYSA-N
Molecular Weight 318.424 g/mol
SMILES N(c1nc2[n](ccc2c(c1C#N)C)Cc1ccccc1)CCCC
SPLASH splash10-002f-9082000000-aa0bf00d37161e746998
Source of Spectrum HC-22-78-0
Wiley ID 1318746