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PGVYMKYGWQTPNF-ZAQCRPJCSA-N
SpectraBase Compound ID J1ZWadndjjK
InChI InChI=1S/C12H16Cl2N2O4/c1-5-10(7(17)4-9(19-2)20-5)16-12(18)11-6(13)3-8(14)15-11/h3,5,7,9-10,15,17H,4H2,1-2H3,(H,16,18)/t5-,7-,9+,10-/m0/s1
InChIKey PGVYMKYGWQTPNF-ZAQCRPJCSA-N
Mol Weight 323.18 g/mol
Molecular Formula C12H16Cl2N2O4
Exact Mass 322.048712 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 84iwsqpu1ps
Name PGVYMKYGWQTPNF-ZAQCRPJCSA-N
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16Cl2N2O4
InChI InChI=1S/C12H16Cl2N2O4/c1-5-10(7(17)4-9(19-2)20-5)16-12(18)11-6(13)3-8(14)15-11/h3,5,7,9-10,15,17H,4H2,1-2H3,(H,16,18)/t5-,7-,9+,10-/m0/s1
InChIKey PGVYMKYGWQTPNF-ZAQCRPJCSA-N
Literature Reference Author I.MOMOSE,S.HIROSAWA,H.NAKAMURA,H.NAGANAWA,H.IINUMA,D.IKEDA,T .TAKEUCHI
Literature Reference Citation J.ANTIBIOTICS,52,787(1999)
Literature Reference DOI 10.7164/antibiotics.52.787
Molecular Weight 323.176 g/mol
Solvent CDCl3
Source File Reference UWRU1033