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3'-SODIUM-SULFONATE-BIOCHANIN-A

View entire compound with spectra: 1 NMR

3'-SODIUM-SULFONATE-BIOCHANIN-A
SpectraBase Compound ID JqGGPilhitr
InChI InChI=1S/C16H12O8S.Na/c1-23-12-3-2-8(4-14(12)25(20,21)22)10-7-24-13-6-9(17)5-11(18)15(13)16(10)19;/h2-7,17-18H,1H3,(H,20,21,22);/q;+1/p-1
InChIKey AQISIBSXMPRZFZ-UHFFFAOYSA-M
Mol Weight 386.31 g/mol
Molecular Formula C16H11NaO8S
Exact Mass 386.007233 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H7XNp8sc2B3
Name 3'-SODIUM-SULFONATE-BIOCHANIN-A
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H11NaO8S
InChI InChI=1S/C16H12O8S.Na/c1-23-12-3-2-8(4-14(12)25(20,21)22)10-7-24-13-6-9(17)5-11(18)15(13)16(10)19;/h2-7,17-18H,1H3,(H,20,21,22);/q;+1/p-1
InChIKey AQISIBSXMPRZFZ-UHFFFAOYSA-M
Literature Reference Author P.LI,X.SHI,Y.WEI,L.QIN,W.SUN,G.XU,T.XU,T.LIU
Literature Reference Citation MOLECULES,20,17016(2015)
Literature Reference DOI 10.3390/molecules200917016
Molecular Weight 386.308 g/mol
Solvent DMSO-D6
Source File Reference UWPA5143