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7-BETA-(3,4-DIMETHOXYCINNAMOYL)-AMINO-3-ACETOXYMETHYL-CEPHALOSPORINE
SpectraBase Compound ID 8aH5BEel7vn
InChI InChI=1S/C21H22N2O8S/c1-11(24)31-9-13-10-32-20-17(19(26)23(20)18(13)21(27)28)22-16(25)7-5-12-4-6-14(29-2)15(8-12)30-3/h4-8,17,20H,9-10H2,1-3H3,(H,22,25)(H,27,28)/b7-5+/t17-,20?/m1/s1
InChIKey WDYGVZDPDJOOJG-KDLWRDFCSA-N
Mol Weight 462.47 g/mol
Molecular Formula C21H22N2O8S
Exact Mass 462.109687 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 39093eqYbfa
Name 7-BETA-(3,4-DIMETHOXYCINNAMOYL)-AMINO-3-ACETOXYMETHYL-CEPHALOSPORINE
Compound Number 1I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22N2O8S
InChI InChI=1S/C21H22N2O8S/c1-11(24)31-9-13-10-32-20-17(19(26)23(20)18(13)21(27)28)22-16(25)7-5-12-4-6-14(29-2)15(8-12)30-3/h4-8,17,20H,9-10H2,1-3H3,(H,22,25)(H,27,28)/b7-5+/t17-,20?/m1/s1
InChIKey WDYGVZDPDJOOJG-KDLWRDFCSA-N
Literature Reference Author M.A.LOPEZ,Z.RODRIGUEZ,M.GONZALEZ,B.TOLON,R.AVILA,T.MAMPOSO,H .VELEZ,A.FINI
Literature Reference Citation MAGN.RES.CHEM.,43,261(2005)
Literature Reference DOI 10.1002/mrc.1525
Molecular Weight 462.474 g/mol
Solvent DMSO-D6
Source File Reference UWSI27021