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(2R,3S)-2-amino-3-(5-cyano-4,5-dihydroisoxazol-3-yl)butyric acid methyl ester
SpectraBase Compound ID EBERLoOVuvs
InChI InChI=1S/C9H13N3O3/c1-5(8(11)9(13)14-2)7-3-6(4-10)15-12-7/h5-6,8H,3,11H2,1-2H3/t5-,6?,8-/m1/s1
InChIKey XAEYMCXQTAMRQY-ONHAXZMJSA-N
Mol Weight 211.22 g/mol
Molecular Formula C9H13N3O3
Exact Mass 211.095691 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A13vWoUE0kJ
Name (2R,3S)-2-amino-3-(5-cyano-4,5-dihydroisoxazol-3-yl)butyric acid methyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13N3O3
InChI InChI=1S/C9H13N3O3/c1-5(8(11)9(13)14-2)7-3-6(4-10)15-12-7/h5-6,8H,3,11H2,1-2H3/t5-,6?,8-/m1/s1
InChIKey XAEYMCXQTAMRQY-ONHAXZMJSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 211.221 g/mol
Source File Reference MHKO25745