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7-BETA-(4-METHYLCINNAMOYL)-AMINO-3-ACETOXYMETHYL-CEPHALOSPORINE
SpectraBase Compound ID IGGBEHHSZ5Q
InChI InChI=1S/C20H20N2O6S/c1-11-3-5-13(6-4-11)7-8-15(24)21-16-18(25)22-17(20(26)27)14(9-28-12(2)23)10-29-19(16)22/h3-8,16,19H,9-10H2,1-2H3,(H,21,24)(H,26,27)/b8-7+/t16-,19?/m1/s1
InChIKey HPURNHBYVAAOIJ-YNWIAHNGSA-N
Mol Weight 416.45 g/mol
Molecular Formula C20H20N2O6S
Exact Mass 416.104208 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AfCnHuLkoHo
Name 7-BETA-(4-METHYLCINNAMOYL)-AMINO-3-ACETOXYMETHYL-CEPHALOSPORINE
Compound Number 1O
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H20N2O6S
InChI InChI=1S/C20H20N2O6S/c1-11-3-5-13(6-4-11)7-8-15(24)21-16-18(25)22-17(20(26)27)14(9-28-12(2)23)10-29-19(16)22/h3-8,16,19H,9-10H2,1-2H3,(H,21,24)(H,26,27)/b8-7+/t16-,19?/m1/s1
InChIKey HPURNHBYVAAOIJ-YNWIAHNGSA-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 416.449 g/mol
Solvent DMSO-D6
Source File Reference UWSI27027