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2-BUTANOYL-3,6,8-TRIHYDROXY-1,4-NAPHTHOQUINONE-6-O-SODIUMSULFATE
SpectraBase Compound ID KbjnRLfIjGP
InChI InChI=1S/C14H12O9S.Na/c1-2-3-8(15)11-13(18)10-7(12(17)14(11)19)4-6(5-9(10)16)23-24(20,21)22;/h4-5,16,19H,2-3H2,1H3,(H,20,21,22);/q;+1/p-1
InChIKey RRWNRCMOWGZLHS-UHFFFAOYSA-M
Mol Weight 378.28 g/mol
Molecular Formula C14H11NaO9S
Exact Mass 378.002147 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fn93bSqLw1j
Name 2-BUTANOYL-3,6,8-TRIHYDROXY-1,4-NAPHTHOQUINONE-6-O-SODIUMSULFATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H11NaO9S
InChI InChI=1S/C14H12O9S.Na/c1-2-3-8(15)11-13(18)10-7(12(17)14(11)19)4-6(5-9(10)16)23-24(20,21)22;/h4-5,16,19H,2-3H2,1H3,(H,20,21,22);/q;+1/p-1
InChIKey RRWNRCMOWGZLHS-UHFFFAOYSA-M
Literature Reference Author D.TAKAHASHI,T.MAOKA,M.TSUSHIMA,K.FUJITANI,M.KOZUKA,T.MATSUNO ,T.SHINGU
Literature Reference Citation CHEM.PHARM.BULL.,50,1609(2002)
Literature Reference DOI 10.1248/cpb.50.1609
Molecular Weight 378.286 g/mol
Solvent D2O
Source File Reference UWMS20305