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2-[1-(Phenylsulfonyl)-3-indolyl]-4-piperidone Ethylene Acetal
SpectraBase Compound ID 34TGyYGt0zb
InChI InChI=1S/C21H22N2O4S/c24-28(25,16-6-2-1-3-7-16)23-15-18(17-8-4-5-9-20(17)23)19-14-21(10-11-22-19)26-12-13-27-21/h1-9,15,19,22H,10-14H2
InChIKey WNJJTMCTFQWTGT-UHFFFAOYSA-N
Mol Weight 398.48 g/mol
Molecular Formula C21H22N2O4S
Exact Mass 398.130028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LugiscpXnZe
Name 2-[1-(Phenylsulfonyl)-3-indolyl]-4-piperidone Ethylene Acetal
Alternate Name(s) 7-[1-(phenylsulfonyl)-1H-indol-3-yl]-1,4-dioxa-8-azaspiro[4.5]decane
CAS Registry Number 130627-34-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N2O4S
InChI InChI=1S/C21H22N2O4S/c24-28(25,16-6-2-1-3-7-16)23-15-18(17-8-4-5-9-20(17)23)19-14-21(10-11-22-19)26-12-13-27-21/h1-9,15,19,22H,10-14H2
InChIKey WNJJTMCTFQWTGT-UHFFFAOYSA-N
Molecular Weight 398.477 g/mol
SMILES N1CCC2(CC1c1c[n](S(=O)(=O)c3ccccc3)c3c1cccc3)OCCO2
SPLASH splash10-004r-9621000000-ef9e03ab38bbbc54f7b8
Source of Spectrum J-56-6296-21
Wiley ID 1368357