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B-Isoxazolin-5-on-2-yl-alanine
SpectraBase Compound ID HXibSiJxJfV
InChI InChI=1S/C6H8N2O4/c7-4(6(10)11)3-8-2-1-5(9)12-8/h1-2,4H,3,7H2,(H,10,11)
InChIKey BDHFFHBFJUZSBF-UHFFFAOYSA-N
Mol Weight 172.14 g/mol
Molecular Formula C6H8N2O4
Exact Mass 172.048407 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7JDfI7bXoRQ
Name BETA-(ISOXAZOLIN-5-ON-2-YL)-ALANINE
Compound Number I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H8N2O4
InChI InChI=1S/C6H8N2O4/c7-4(6(10)11)3-8-2-1-5(9)12-8/h1-2,4H,3,7H2,(H,10,11)
InChIKey BDHFFHBFJUZSBF-UHFFFAOYSA-N
Literature Reference Author F.LAMBEIN,J.K.KHAN,C.BECU,A.D.BRUYN
Literature Reference Citation PHYTOCHEM.,31,887(1992)
Literature Reference DOI 10.1016/0031-9422(92)80033-b
Molecular Weight 172.141 g/mol
Solvent D2O
Source File Reference UWVN4927