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cis-3-Ethyl-2-[1-(Phenylsulfonyl)-3-indolyl]-4-piperidone Ethylene Acetal
SpectraBase Compound ID 58rMG3bJld6
InChI InChI=1S/C23H26N2O4S/c1-2-20-22(24-13-12-23(20)28-14-15-29-23)19-16-25(21-11-7-6-10-18(19)21)30(26,27)17-8-4-3-5-9-17/h3-11,16,20,22,24H,2,12-15H2,1H3/t20-,22+/m0/s1
InChIKey JSFWWDQEGYDAPJ-RBBKRZOGSA-N
Mol Weight 426.53 g/mol
Molecular Formula C23H26N2O4S
Exact Mass 426.161328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9ank3cP9Th
Name cis-3-Ethyl-2-[1-(Phenylsulfonyl)-3-indolyl]-4-piperidone Ethylene Acetal
Alternate Name(s) (6S,7S)-6-ethyl-7-[1-(phenylsulfonyl)-1H-indol-3-yl]-1,4-dioxa-8-azaspiro[4.5]decane
CAS Registry Number 132113-32-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26N2O4S
InChI InChI=1S/C23H26N2O4S/c1-2-20-22(24-13-12-23(20)28-14-15-29-23)19-16-25(21-11-7-6-10-18(19)21)30(26,27)17-8-4-3-5-9-17/h3-11,16,20,22,24H,2,12-15H2,1H3/t20-,22+/m0/s1
InChIKey JSFWWDQEGYDAPJ-RBBKRZOGSA-N
Molecular Weight 426.531 g/mol
SMILES N1CCC2([C@]([C@]1(c1c[n](S(=O)(=O)c3ccccc3)c3c1cccc3)[H])(CC)[H])OCCO2
SPLASH splash10-004i-9100000000-d6fa901a4b824006b02f
Source of Spectrum J-56-6296-23
Wiley ID 1379911