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NDDRDBLIDTYRTJ-HGKIGUAWSA-M
SpectraBase Compound ID 8fm5Qc3qNxj
InChI InChI=1S/C7H13NO3.Na/c1-6(2)5-8(11)4-3-7(9)10;/h5-6H,3-4H2,1-2H3,(H,9,10);/q;+1/p-1/b8-5-;
InChIKey NDDRDBLIDTYRTJ-HGKIGUAWSA-M
Mol Weight 181.17 g/mol
Molecular Formula C7H12NNaO3
Exact Mass 181.071488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GCco0yE98Kz
Name NDDRDBLIDTYRTJ-HGKIGUAWSA-M
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12NNaO3
InChI InChI=1S/C7H13NO3.Na/c1-6(2)5-8(11)4-3-7(9)10;/h5-6H,3-4H2,1-2H3,(H,9,10);/q;+1/p-1/b8-5-;
InChIKey NDDRDBLIDTYRTJ-HGKIGUAWSA-M
Literature Reference Author J.MARCHAND-BRYNAERT,Z.BOUNKHALA-KHROUZ,H.VANLIERDE,L.GHOSEZ
Literature Reference Citation HETEROCYCLES,30,971(1990)
Literature Reference DOI 10.3987/COM-89-S96
Molecular Weight 181.167 g/mol
Solvent CD3OD
Source File Reference UWMZ1099