For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-Cano-3-(3-indolylmethyl)-1-methyl-4-(phenylsulfonyl)piperidine
SpectraBase Compound ID 2gysnH7fErV
InChI InChI=1S/C22H23N3O2S/c1-25-12-11-22(28(26,27)17-7-3-2-4-8-17)19(21(25)14-23)13-16-15-24-20-10-6-5-9-18(16)20/h2-10,15,19,21-22,24H,11-13H2,1H3
InChIKey DYHNIBOKZGGQPT-UHFFFAOYSA-N
Mol Weight 393.51 g/mol
Molecular Formula C22H23N3O2S
Exact Mass 393.151098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1DzMxQoiyO
Name 2-Cano-3-(3-indolylmethyl)-1-methyl-4-(phenylsulfonyl)piperidine
CAS Registry Number 143924-23-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23N3O2S
InChI InChI=1S/C22H23N3O2S/c1-25-12-11-22(28(26,27)17-7-3-2-4-8-17)19(21(25)14-23)13-16-15-24-20-10-6-5-9-18(16)20/h2-10,15,19,21-22,24H,11-13H2,1H3
InChIKey DYHNIBOKZGGQPT-UHFFFAOYSA-N
Molecular Weight 393.505 g/mol
SMILES [nH]1c2c(c(c1)CC1C(S(=O)(=O)c3ccccc3)CCN(C)C1C#N)cccc2
SPLASH splash10-001i-0790000000-0cc0c997df5d867b7972
Source of Spectrum J-57-6420-37
Synonyms 3-(1H-indol-3-ylmethyl)-1-methyl-4-(phenylsulfonyl)-2-piperidinecarbonitrile
Wiley ID 1366286