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2-O-(1,3-PROPYLENDIOXYTHIOPHOSPHORYL)-5,6-O-ISOPROPYLIDENE-L-ASCORBINIC ACID
SpectraBase Compound ID HZBZdt5QNxr
InChI InChI=1S/C12H17O8PS/c1-12(2)15-6-7(19-12)9-8(13)10(11(14)18-9)20-21(22)16-4-3-5-17-21/h7,9,13H,3-6H2,1-2H3
InChIKey QUAISPOFXAATHK-UHFFFAOYSA-N
Mol Weight 352.29 g/mol
Molecular Formula C12H17O8PS
Exact Mass 352.038176 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JJ3T1ZnptSw
Name 2-O-(1,3-PROPYLENDIOXYTHIOPHOSPHORYL)-5,6-O-ISOPROPYLIDENE-L-ASCORBINIC ACID
Comments , I(62.16):I(62.76)=8:2. MIXTURE WITH 3-O-(1,3-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H17O8PS
InChI InChI=1S/C12H17O8PS/c1-12(2)15-6-7(19-12)9-8(13)10(11(14)18-9)20-21(22)16-4-3-5-17-21/h7,9,13H,3-6H2,1-2H3
InChIKey QUAISPOFXAATHK-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference D.A.PREDVODITELEV, M.A.MALENKOVSKAYA, A.R.BEKKER, L.K.VASYANINA, E.E.NIFANT'EV(1991) Zhurn.Org.Khim.(Russ. Lang.): v.27, N8, 1655-1668.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CHCl3 chloroform