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3-(1-besyl-6-hydroxy-indol-4-yl)-1-propyl-2-piperidone
SpectraBase Compound ID DFN2w29iIwG
InChI InChI=1S/C22H24N2O4S/c1-2-11-23-12-6-9-19(22(23)26)20-14-16(25)15-21-18(20)10-13-24(21)29(27,28)17-7-4-3-5-8-17/h3-5,7-8,10,13-15,19,25H,2,6,9,11-12H2,1H3
InChIKey UNDXUCMXVHQGPE-UHFFFAOYSA-N
Mol Weight 412.5 g/mol
Molecular Formula C22H24N2O4S
Exact Mass 412.145678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKPnBcRv1bs
Name 3-(1-besyl-6-hydroxy-indol-4-yl)-1-propyl-2-piperidone
Alternate Name(s) 3-[1-(benzenesulfonyl)-6-hydroxy-4-indolyl]-1-propyl-2-piperidinone 3-[1-(benzenesulfonyl)-6-hydroxy-indol-4-yl]-1-propyl-piperidin-2-one 3-[6-oxidanyl-1-(phenylsulfonyl)indol-4-yl]-1-propyl-piperidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O4S
InChI InChI=1S/C22H24N2O4S/c1-2-11-23-12-6-9-19(22(23)26)20-14-16(25)15-21-18(20)10-13-24(21)29(27,28)17-7-4-3-5-8-17/h3-5,7-8,10,13-15,19,25H,2,6,9,11-12H2,1H3
InChIKey UNDXUCMXVHQGPE-UHFFFAOYSA-N
Molecular Weight 412.504 g/mol
SMILES Oc1cc(c2cc[n](c2c1)S(=O)(=O)c1ccccc1)C1C(N(CCC1)CCC)=O
SPLASH splash10-03n9-5780900000-1bbd5ef247cf28f0c83d
Source of Spectrum E1-40-2351-43
Wiley ID 1519743