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(2R*,3R*,4S*)-1-(phenylsufonyl)-2-ethoxy-3-methyl-4-phenyl-6-(ethoxycarbonyl)-1,2,3,4-hydropyridine
SpectraBase Compound ID KQXiHStXh3r
InChI InChI=1S/C23H27NO5S/c1-4-28-22-17(3)20(18-12-8-6-9-13-18)16-21(23(25)29-5-2)24(22)30(26,27)19-14-10-7-11-15-19/h6-17,20,22H,4-5H2,1-3H3/t17-,20+,22-/m1/s1
InChIKey PUTKTMXLVQJLRT-PIPMEXSNSA-N
Mol Weight 429.53 g/mol
Molecular Formula C23H27NO5S
Exact Mass 429.160994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 90tdh6fXFOk
Name (2R*,3R*,4S*)-1-(phenylsufonyl)-2-ethoxy-3-methyl-4-phenyl-6-(ethoxycarbonyl)-1,2,3,4-hydropyridine
Alternate Name(s) (2R,3S*,4S*)-1-(phenylsufonyl)-2-(ethoxy)-3-methyl-4-phenyl-6-(ethoxycarbonyl)-1,2,3,4-hydropyridine Ethyl (4S,5R,6R)-6-ethoxy-5-methyl-4-phenyl-1-(phenylsulfonyl)-1,4,5,6-tetrahydro-2-pyridinecarboxylate
CAS Registry Number 132646-95-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27NO5S
InChI InChI=1S/C23H27NO5S/c1-4-28-22-17(3)20(18-12-8-6-9-13-18)16-21(23(25)29-5-2)24(22)30(26,27)19-14-10-7-11-15-19/h6-17,20,22H,4-5H2,1-3H3/t17-,20+,22-/m1/s1
InChIKey PUTKTMXLVQJLRT-PIPMEXSNSA-N
Molecular Weight 429.531 g/mol
SMILES C=1(N([C@@]([C@@]([C@](C1)(c1ccccc1)[H])(C)[H])(OCC)[H])S(=O)(=O)c1ccccc1)C(=O)OCC
SPLASH splash10-0553-9220000000-6b8237401a4834e1e588
Source of Spectrum C-113-1725-30
Wiley ID 1381173