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2-amino-5-[(1R,2R,3R)-1,2,3,4-tetrahydroxybutyl]nicotinonitrile

View entire compound with spectra: 1 NMR

2-amino-5-[(1R,2R,3R)-1,2,3,4-tetrahydroxybutyl]nicotinonitrile
SpectraBase Compound ID 8uausashlCe
InChI InChI=1S/C10H13N3O4/c11-2-5-1-6(3-13-10(5)12)8(16)9(17)7(15)4-14/h1,3,7-9,14-17H,4H2,(H2,12,13)/t7-,8-,9+/m1/s1
InChIKey XIPNQKUWHNAGBE-HLTSFMKQSA-N
Mol Weight 239.23 g/mol
Molecular Formula C10H13N3O4
Exact Mass 239.090606 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8JHgxpTmIdN
Name 2-amino-5-[(1R,2R,3R)-1,2,3,4-tetrahydroxybutyl]nicotinonitrile
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H13N3O4
InChI InChI=1S/C10H13N3O4/c11-2-5-1-6(3-13-10(5)12)8(16)9(17)7(15)4-14/h1,3,7-9,14-17H,4H2,(H2,12,13)/t7-,8-,9+/m1/s1
InChIKey XIPNQKUWHNAGBE-HLTSFMKQSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 239.231 g/mol
Source File Reference MHKO11177