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DIHYDROVITAMIN K1, 1-MONOPHOSPHATE
SpectraBase Compound ID 3hqrlhkfeDv
InChI InChI=1S/C31H49O5P/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)31(36-37(33,34)35)29-19-8-7-18-28(29)30(27)32/h7-8,18-20,22-24,32H,9-17,21H2,1-6H3,(H2,33,34,35)/b25-20+
InChIKey LACLWYAMQVBJBQ-LKUDQCMESA-N
Mol Weight 532.7 g/mol
Molecular Formula C31H49O5P
Exact Mass 532.331762 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3GvCqM0gJsn
Name DIHYDROVITAMIN K1, 1-MONOPHOSPHATE
Comments , CDCL3:CD4O=1:1, SCALE INVERTED!
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Formula C31H49O5P
InChI InChI=1S/C31H49O5P/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)31(36-37(33,34)35)29-19-8-7-18-28(29)30(27)32/h7-8,18-20,22-24,32H,9-17,21H2,1-6H3,(H2,33,34,35)/b25-20+
InChIKey LACLWYAMQVBJBQ-LKUDQCMESA-N
Instrument Name Bruker WP-60
Literature Reference E.E.ZHUKOVA, E.I.ZAKHAROVA, I.K.SARYCHEVA, R.P.EVSTIGNEEVA (1988)Bioorganich.Khim.(Russ. Lang.): v.14, N5, 681-688.
NMR Standard -H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3/CD4O