John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=2rqaZ3MpBB1 SpectraBase Spectrum ID=6Dkk8EFjoO9

(accessed ).
GWUYRXBKXOURDF-XDYITYJNSA-N
SpectraBase Compound ID 2rqaZ3MpBB1
InChI InChI=1S/C13H16N2O7/c1-2-3-9(17)21-6-7-10(18)11(19)12(22-7)15-5-4-8(16)14-13(15)20/h2-5,7,10-12,18-19H,6H2,1H3,(H,14,16,20)/b3-2+/t7-,10-,11-,12-/m0/s1
InChIKey GWUYRXBKXOURDF-XDYITYJNSA-N
Mol Weight 312.28 g/mol
Molecular Formula C13H16N2O7
Exact Mass 312.095751 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Dkk8EFjoO9
Name GWUYRXBKXOURDF-XDYITYJNSA-N
Compound Number 7F
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16N2O7
InChI InChI=1S/C13H16N2O7/c1-2-3-9(17)21-6-7-10(18)11(19)12(22-7)15-5-4-8(16)14-13(15)20/h2-5,7,10-12,18-19H,6H2,1H3,(H,14,16,20)/b3-2+/t7-,10-,11-,12-/m0/s1
InChIKey GWUYRXBKXOURDF-XDYITYJNSA-N
Literature Reference Author F.MORIS,V.GOTOR
Literature Reference Citation J.ORG.CHEM.,58,653(1993)
Literature Reference DOI 10.1021/jo00055a018
Molecular Weight 312.279 g/mol
Solvent DMSO-D6
Source File Reference UWCS18856
SpectraBase Batch ID 5g5guff7ZiU