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RES-1214-1
SpectraBase Compound ID IrFm7Xv42F8
InChI InChI=1S/C17H16O8/c1-8-4-11(18)14(16(20)21)13(5-8)25-15-10(17(22)24-3)6-9(23-2)7-12(15)19/h4-7,18-19H,1-3H3,(H,20,21)
InChIKey SOXXAFVUSIMAGB-UHFFFAOYSA-N
Mol Weight 348.31 g/mol
Molecular Formula C17H16O8
Exact Mass 348.084517 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LCVRcJKpw8O
Name 2-(2'-HYDROXY-4'-METHOXY-6'-METHOXYCARBONYL-PHENOXY)-6-HYDROXY-4-METHYL-BENZOIC-ACID;DECHLORO-DIHYDRO-MALDOXIN
Compound Number 3
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C17H16O8/c1-8-4-11(18)14(16(20)21)13(5-8)25-15-10(17(22)24-3)6-9(23-2)7-12(15)19/h4-7,18-19H,1-3H3,(H,20,21)
InChIKey SOXXAFVUSIMAGB-UHFFFAOYSA-N
Literature Reference M.O.ADEBOYA,R.L.EDWARDS,T.LASSOE,D.J.MAITLAND,L.SHIELDS,A.J.S.WHALLEY J.CHEM.SOC.PERKIN-1,1419(1996)
Solvent Pyridine-d5
Technique APT, DEPT, INEPT; C/H SHIFT CORRELATION