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Mecillinam
SpectraBase Compound ID 89de3KIsIKn
InChI InChI=1S/C15H23N3O3S/c1-15(2)11(14(20)21)18-12(19)10(13(18)22-15)16-9-17-7-5-3-4-6-8-17/h9-11,13H,3-8H2,1-2H3,(H,20,21)/b16-9+/t10-,11+,13-/m1/s1
InChIKey BWWVAEOLVKTZFQ-ISVUSNJMSA-N
Mol Weight 325.43 g/mol
Molecular Formula C15H23N3O3S
Exact Mass 325.146013 g/mol
Enantiomer InChIKey BWWVAEOLVKTZFQ-FFHOYIHNSA-N
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Fluka Vetranal, Sigma-Aldrich Inc.
Source of Spectrum Forensic Spectral Research
Catalog Number 33447
Copyright Copyright © 2013-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Fluka, Sigma-Aldrich Company Llc.
Source of Spectrum Forensic Spectral Research
Catalog Number 33447
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent D2O
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
  • 6R-MECILLINAM-HYDROCHLORIDE
  • 6S-MECILLINAM-HYDROCHLORIDE
Title Journal or Book Year
Carbon-13 NMR of β-lactam antibiotics and related compounds Magnetic Resonance in Chemistry 1986

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