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2-amino-5-(2,4-diketopyrimidin-1-yl)valeric acid

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2-amino-5-(2,4-diketopyrimidin-1-yl)valeric acid
SpectraBase Compound ID JjTRakFOluT
InChI InChI=1S/C9H13N3O4/c10-6(8(14)15)2-1-4-12-5-3-7(13)11-9(12)16/h3,5-6H,1-2,4,10H2,(H,14,15)(H,11,13,16)
InChIKey IOBNGWHKQIMVAT-UHFFFAOYSA-N
Mol Weight 227.22 g/mol
Molecular Formula C9H13N3O4
Exact Mass 227.090606 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2PK2FnTHkDX
Name 2-amino-5-(2,4-diketopyrimidin-1-yl)valeric acid
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13N3O4
InChI InChI=1S/C9H13N3O4/c10-6(8(14)15)2-1-4-12-5-3-7(13)11-9(12)16/h3,5-6H,1-2,4,10H2,(H,14,15)(H,11,13,16)
InChIKey IOBNGWHKQIMVAT-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 227.220 g/mol
Source File Reference MHKO2195