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1-[2-[1-(benzenesulfonyl)-2-(2-oxanyloxymethyl)-3-indolyl]ethyl]-3,3-dimethoxy-2-piperidinone
SpectraBase Compound ID 6OldfntNerj
InChI InChI=1S/C29H36N2O7S/c1-35-29(36-2)17-10-18-30(28(29)32)19-16-24-23-13-6-7-14-25(23)31(39(33,34)22-11-4-3-5-12-22)26(24)21-38-27-15-8-9-20-37-27/h3-7,11-14,27H,8-10,15-21H2,1-2H3
InChIKey YXUIPWSDDCCABJ-UHFFFAOYSA-N
Mol Weight 556.7 g/mol
Molecular Formula C29H36N2O7S
Exact Mass 556.224323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HMQRmvniPko
Name 1-[2-[1-(benzenesulfonyl)-2-(2-oxanyloxymethyl)-3-indolyl]ethyl]-3,3-dimethoxy-2-piperidinone
Alternate Name(s) 1-[2-[1-(benzenesulfonyl)-2-(oxan-2-yloxymethyl)indol-3-yl]ethyl]-3,3-dimethoxypiperidin-2-one 1-[2-[1-(benzenesulfonyl)-2-(tetrahydropyran-2-yloxymethyl)indol-3-yl]ethyl]-3,3-dimethoxy-piperidin-2-one 1-[2-[1-besyl-2-(tetrahydropyran-2-yloxymethyl)indol-3-yl]ethyl]-3,3-dimethoxy-2-piperidone 3,3-Dimethoxy-1-[2-[2-(oxan-2-yloxymethyl)-1-(phenylsulfonyl)indol-3-yl]ethyl]piperidin-2-one
CAS Registry Number 108913-74-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H36N2O7S
InChI InChI=1S/C29H36N2O7S/c1-35-29(36-2)17-10-18-30(28(29)32)19-16-24-23-13-6-7-14-25(23)31(39(33,34)22-11-4-3-5-12-22)26(24)21-38-27-15-8-9-20-37-27/h3-7,11-14,27H,8-10,15-21H2,1-2H3
InChIKey YXUIPWSDDCCABJ-UHFFFAOYSA-N
Molecular Weight 556.674 g/mol
SMILES c1(S([n]2c(c(CCN3C(C(OC)(OC)CCC3)=O)c3c2cccc3)COC2OCCCC2)(=O)=O)ccccc1
SPLASH splash10-02cg-4930200000-32458f82303fbe33ddd4
Source of Spectrum F-42-1508-17
Wiley ID 1406382