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CALYSTEGINE-B1
SpectraBase Compound ID 2C46d7HLLIv
InChI InChI=1S/C7H13NO4/c9-4-1-3-5(10)2-7(12,8-3)6(4)11/h3-6,8-12H,1-2H2/t3-,4+,5-,6-,7+/m0/s1
InChIKey BQFFLYRIKODYEN-MLKOFDEISA-N
Mol Weight 175.18 g/mol
Molecular Formula C7H13NO4
Exact Mass 175.084458 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6hMfBG655uF
Name CALYSTEGINE-B1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H13NO4
InChI InChI=1S/C7H13NO4/c9-4-1-3-5(10)2-7(12,8-3)6(4)11/h3-6,8-12H,1-2H2/t3-,4+,5-,6-,7+/m0/s1
InChIKey BQFFLYRIKODYEN-MLKOFDEISA-N
Literature Reference Author Y.SCHOLL,B.SCHNEIDER,B.DRAEGER
Literature Reference Citation PHYTOCHEM.,62,325(2003)
Literature Reference DOI 10.1016/S0031-9422(02)00544-7
Solvent H2O:D2O=9:1;PH=4_OR_D2O
Source File Reference UWMS28375