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Phenoxymethyl-anhydro-penicillin
SpectraBase Compound ID IxyJQZ6P5E0
InChI InChI=1S/C16H16N2O4S/c1-9(2)13-16(21)23-15-12(14(20)18(13)15)17-11(19)8-22-10-6-4-3-5-7-10/h3-7,12,15H,8H2,1-2H3,(H,17,19)
InChIKey BRZUAOOYURQIIO-UHFFFAOYSA-N
Mol Weight 332.37 g/mol
Molecular Formula C16H16N2O4S
Exact Mass 332.083078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LPzrptmNaZG
Name Phenoxymethyl-anhydro-penicillin
CAS Registry Number 47295-33-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H16N2O4S
InChI InChI=1S/C16H16N2O4S/c1-9(2)13-16(21)23-15-12(14(20)18(13)15)17-11(19)8-22-10-6-4-3-5-7-10/h3-7,12,15H,8H2,1-2H3,(H,17,19)
InChIKey BRZUAOOYURQIIO-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference R.F. Pratt, Y.S. Surh, J.J. Shaskus, J. Am. Chem. Soc. 105, 1006 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3