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[2R,6R,2(4S,5S)]-2-(4-methyl-2-thioxo-1,3-dioxolanyl)-6-methyl-N-(p-tolylsulfonyl)piperidine

View entire compound with spectra: 1 MS (GC)

[2R,6R,2(4S,5S)]-2-(4-methyl-2-thioxo-1,3-dioxolanyl)-6-methyl-N-(p-tolylsulfonyl)piperidine
SpectraBase Compound ID 5fRUxmIcZWZ
InChI InChI=1S/C17H23NO4S2/c1-11-7-9-14(10-8-11)24(19,20)18-12(2)5-4-6-15(18)16-13(3)21-17(23)22-16/h7-10,12-13,15-16H,4-6H2,1-3H3/t12-,13+,15-,16-/m1/s1
InChIKey FGBHDFULQHLRHE-OCVGTWLNSA-N
Mol Weight 369.49 g/mol
Molecular Formula C17H23NO4S2
Exact Mass 369.106851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Zjnlc1BauB
Name [2R,6R,2(4S,5S)]-2-(4-methyl-2-thioxo-1,3-dioxolanyl)-6-methyl-N-(p-tolylsulfonyl)piperidine
CAS Registry Number 118014-75-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NO4S2
InChI InChI=1S/C17H23NO4S2/c1-11-7-9-14(10-8-11)24(19,20)18-12(2)5-4-6-15(18)16-13(3)21-17(23)22-16/h7-10,12-13,15-16H,4-6H2,1-3H3/t12-,13+,15-,16-/m1/s1
InChIKey FGBHDFULQHLRHE-OCVGTWLNSA-N
Molecular Weight 369.494 g/mol
SMILES [C@@]1(N(S(c2ccc(cc2)C)(=O)=O)[C@@](CCC1)(C)[H])([C@@]1(OC(=S)O[C@]1(C)[H])[H])[H]
SPLASH splash10-0udl-4290000000-4ffb23728b769f03629b
Source of Spectrum C-111-1408-68
Synonyms (4S,5S)-4-methyl-5-{(2R,6R)-6-methyl-1-[(4-methylphenyl)sulfonyl]piperidinyl}-1,3-dioxolane-2-thione
Wiley ID 1353553