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N-ACETYLAMPICILLIN-PHTHALIMIDOMETHYLESTER

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N-ACETYLAMPICILLIN-PHTHALIMIDOMETHYLESTER
SpectraBase Compound ID 6dtKyQWeijP
InChI InChI=1S/C27H26N4O7S/c1-14(32)28-18(15-9-5-4-6-10-15)21(33)29-19-24(36)31-20(27(2,3)39-25(19)31)26(37)38-13-30-22(34)16-11-7-8-12-17(16)23(30)35/h4-12,18-20,25H,13H2,1-3H3,(H,28,32)(H,29,33)/t18-,19+,20-,25?/m0/s1
InChIKey ADGINVBCEIKCGC-MAELHVQTSA-N
Mol Weight 550.59 g/mol
Molecular Formula C27H26N4O7S
Exact Mass 550.15222 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ArHfXvbisvD
Name N-ACETYLAMPICILLIN-PHTHALIMIDOMETHYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H26N4O7S
InChI InChI=1S/C27H26N4O7S/c1-14(32)28-18(15-9-5-4-6-10-15)21(33)29-19-24(36)31-20(27(2,3)39-25(19)31)26(37)38-13-30-22(34)16-11-7-8-12-17(16)23(30)35/h4-12,18-20,25H,13H2,1-3H3,(H,28,32)(H,29,33)/t18-,19+,20-,25?/m0/s1
InChIKey ADGINVBCEIKCGC-MAELHVQTSA-N
Literature Reference Author I.PATERNOTTE,H.J.FAN,P.SCREVE,M.CLAESEN,P.M.TULKENS,E.SONVEA UX
Literature Reference Citation BIOORG.MED.CHEM.,9,493(2001)
Literature Reference DOI 10.1016/S0968-0896(00)00255-8
Molecular Weight 550.586 g/mol
Solvent CDCl3
Source File Reference UWLU21775