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3-ALPHA-CHLOROMETHYL-3-BETA-METHYLTHIO-1-OXACEPHAM-BENZHYDRYLESTER
SpectraBase Compound ID AlZcRtrE8US
InChI InChI=1S/C29H27ClN2O5S/c1-38-29(17-30)18-36-27-22(31-25(33)21-15-9-4-10-16-21)26(34)32(27)24(29)28(35)37-23(19-11-5-2-6-12-19)20-13-7-3-8-14-20/h2-16,22-24,27H,17-18H2,1H3,(H,31,33)
InChIKey XNTSMFRKLBASHC-UHFFFAOYSA-N
Mol Weight 551.06 g/mol
Molecular Formula C29H27ClN2O5S
Exact Mass 550.132921 g/mol
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Title Journal or Book Year
Stereochemical Studies of 1-Oxacephams by Means of NMR Spectroscopy. A Useful Shift Rule for Determination of the 3-Substituent Configration HETEROCYCLES 1987

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