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X=NA

View entire compound with spectra: 1 NMR

X=NA
SpectraBase Compound ID FGKaBXjSPQz
InChI InChI=1S/C16H14O12S2.2Na/c17-11-3-2-10(8-12(11)18)15-16(28-30(22,23)24)27-13-4-1-9(7-14(13)26-15)5-6-25-29(19,20)21;;/h1-8,15-18H,(H,19,20,21)(H,22,23,24);;/q;2*+1/p-2/b6-5+;;
InChIKey GEKRVOWIMFFGED-TXOOBNKBSA-L
Mol Weight 506.35953856 g/mol
Molecular Formula C16H12Na2O12S2
Exact Mass 505.956557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JxZmQHJ6fxp
Name X=NA
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12Na2O12S2
InChI InChI=1S/C16H14O12S2.2Na/c17-11-3-2-10(8-12(11)18)15-16(28-30(22,23)24)27-13-4-1-9(7-14(13)26-15)5-6-25-29(19,20)21;;/h1-8,15-18H,(H,19,20,21)(H,22,23,24);;/q;2*+1/p-2/b6-5+;;
InChIKey GEKRVOWIMFFGED-TXOOBNKBSA-L
Literature Reference Author Y.H.CHANG,D.SHIN,Z.NA,H.S.LEE,D.D.KIM,K.B.OH,J.SHIN
Literature Reference Citation J.NAT.PROD.,71,779(2008)
Literature Reference DOI 10.1021/np078015z
Molecular Weight 506.364 g/mol
Sample ID 28214
Solvent DMSO-D6