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(2R*,4S*)-1-(phenylsufonyl)-2-benzyloxy-4-phenyl-6-(ethoxycarbonyl)-1,2,3,4-hydropyridine
SpectraBase Compound ID F7IgEJoIuE0
InChI InChI=1S/C27H27NO5S/c1-2-32-27(29)25-18-23(22-14-8-4-9-15-22)19-26(33-20-21-12-6-3-7-13-21)28(25)34(30,31)24-16-10-5-11-17-24/h3-18,23,26H,2,19-20H2,1H3/t23-,26-/m1/s1
InChIKey ZVJAKJCKISXROO-ZEQKJWHPSA-N
Mol Weight 477.58 g/mol
Molecular Formula C27H27NO5S
Exact Mass 477.160994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KuMExbNVOFs
Name (2R*,4S*)-1-(phenylsufonyl)-2-benzyloxy-4-phenyl-6-(ethoxycarbonyl)-1,2,3,4-hydropyridine
Alternate Name(s) Ethyl (4S,6R)-6-(benzyloxy)-4-phenyl-1-(phenylsulfonyl)-1,4,5,6-tetrahydro-2-pyridinecarboxylate
CAS Registry Number 132646-92-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H27NO5S
InChI InChI=1S/C27H27NO5S/c1-2-32-27(29)25-18-23(22-14-8-4-9-15-22)19-26(33-20-21-12-6-3-7-13-21)28(25)34(30,31)24-16-10-5-11-17-24/h3-18,23,26H,2,19-20H2,1H3/t23-,26-/m1/s1
InChIKey ZVJAKJCKISXROO-ZEQKJWHPSA-N
Molecular Weight 477.575 g/mol
SMILES C=1(N([C@@](C[C@@](C1)(c1ccccc1)[H])(OCc1ccccc1)[H])S(=O)(=O)c1ccccc1)C(=O)OCC
SPLASH splash10-0006-9010000000-e5bf4e95b43d5443c232
Source of Spectrum C-113-1725-27
Wiley ID 1394558