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METHYL-3-(2-METHYL-5-NITRO-1H-IMIDAZOL-1-YL)-PROPANOATE
SpectraBase Compound ID 4ctuqvN66H4
InChI InChI=1S/C8H11N3O4/c1-6-9-5-7(11(13)14)10(6)4-3-8(12)15-2/h5H,3-4H2,1-2H3
InChIKey ICWABKGVJUCBAL-UHFFFAOYSA-N
Mol Weight 213.19 g/mol
Molecular Formula C8H11N3O4
Exact Mass 213.074956 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ch3spNVCyMW
Name METHYL-3-(2-METHYL-5-NITRO-1H-IMIDAZOL-1-YL)-PROPANOATE
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H11N3O4
InChI InChI=1S/C8H11N3O4/c1-6-9-5-7(11(13)14)10(6)4-3-8(12)15-2/h5H,3-4H2,1-2H3
InChIKey ICWABKGVJUCBAL-UHFFFAOYSA-N
Literature Reference Author S.BONCEL,K.SALETRA,B.HEFCZYC,K.Z.WALCZAK
Literature Reference Citation BEIL.J.ORG.CHEM.,7,173(2011)
Literature Reference DOI 10.3762/bjoc.7.24
Molecular Weight 213.193 g/mol
Solvent CDCl3
Source File Reference UWBT9667