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(2S,3R)-2-(1-besylindol-2-yl)-3-ethyl-4-piperidone
SpectraBase Compound ID M0yOcxU1zU
InChI InChI=1S/C21H22N2O3S/c1-2-17-20(24)12-13-22-21(17)19-14-15-8-6-7-11-18(15)23(19)27(25,26)16-9-4-3-5-10-16/h3-11,14,17,21-22H,2,12-13H2,1H3/t17-,21-/m0/s1
InChIKey SOUYOBCMWZNLKC-UWJYYQICSA-N
Mol Weight 382.48 g/mol
Molecular Formula C21H22N2O3S
Exact Mass 382.135114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ei76qO91ZEI
Name (2S,3R)-2-(1-besylindol-2-yl)-3-ethyl-4-piperidone
CAS Registry Number 130179-24-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N2O3S
InChI InChI=1S/C21H22N2O3S/c1-2-17-20(24)12-13-22-21(17)19-14-15-8-6-7-11-18(15)23(19)27(25,26)16-9-4-3-5-10-16/h3-11,14,17,21-22H,2,12-13H2,1H3/t17-,21-/m0/s1
InChIKey SOUYOBCMWZNLKC-UWJYYQICSA-N
Molecular Weight 382.478 g/mol
SMILES N1CCC([C@@]([C@]1(c1[n](S(=O)(=O)c2ccccc2)c2c(cccc2)c1)[H])(CC)[H])=O
SPLASH splash10-004i-9201000000-d55aeeda9d6705c2827f
Source of Spectrum F-46-4453-18
Synonyms (2S,3R)-2-[1-(benzenesulfonyl)-2-indolyl]-3-ethyl-4-piperidinone (2S,3R)-2-[1-(benzenesulfonyl)indol-2-yl]-3-ethyl-piperidin-4-one (2S,3R)-3-ethyl-2-[1-(phenylsulfonyl)indol-2-yl]piperidin-4-one
Wiley ID 1360546