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3-(3-Phenylthioindol-2-yl)-2-(3-pyridyl)propionitrile
SpectraBase Compound ID IM8tQQL16tC
InChI InChI=1S/C22H17N3S/c23-14-17(16-7-6-12-24-15-16)13-21-22(26-18-8-2-1-3-9-18)19-10-4-5-11-20(19)25-21/h1-12,15,17,25H,13H2
InChIKey LXEUWDGZNHJRHI-UHFFFAOYSA-N
Mol Weight 355.46 g/mol
Molecular Formula C22H17N3S
Exact Mass 355.114319 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8to1TaNlVh0
Name 3-(3-Phenylthioindol-2-yl)-2-(3-pyridyl)propionitrile
Alternate Name(s) 3-[3-(phenylsulfanyl)-1H-indol-2-yl]-2-(3-pyridinyl)propanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17N3S
InChI InChI=1S/C22H17N3S/c23-14-17(16-7-6-12-24-15-16)13-21-22(26-18-8-2-1-3-9-18)19-10-4-5-11-20(19)25-21/h1-12,15,17,25H,13H2
InChIKey LXEUWDGZNHJRHI-UHFFFAOYSA-N
Molecular Weight 355.459 g/mol
SMILES [nH]1c2ccccc2c(c1CC(C#N)c1cnccc1)Sc1ccccc1
SPLASH splash10-03di-0940000000-f7609c05b06985067322
Source of Spectrum Y1-31-686-9
Wiley ID 1525914