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Benzoic acid, 2-hydroxy-4-[(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy]-3,6-dimethyl-
SpectraBase Compound ID LxHnQKbpcSi
InChI InChI=1S/C18H18O7/c1-8-5-11(24-4)7-12(19)14(8)18(23)25-13-6-9(2)15(17(21)22)16(20)10(13)3/h5-7,19-20H,1-4H3,(H,21,22)
InChIKey FVYOPZXVFTVTDA-UHFFFAOYSA-N
Mol Weight 346.34 g/mol
Molecular Formula C18H18O7
Exact Mass 346.105253 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C4SvgjjJCtD
Name Benzoic acid, 2-hydroxy-4-[(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy]-3,6-dimethyl-
Comments Computed using HOSE algorithm
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Exact Mass 346.105252913 u
Formula C18H18O7
InChI InChI=1S/C18H18O7/c1-8-5-11(24-4)7-12(19)14(8)18(23)25-13-6-9(2)15(17(21)22)16(20)10(13)3/h5-7,19-20H,1-4H3,(H,21,22)
InChIKey FVYOPZXVFTVTDA-UHFFFAOYSA-N
Molecular Weight 346.335 g/mol
SMILES C=1(C(=C(C)C(=CC1C)OC(C=1C(=CC(=CC1C)OC)O)=O)O)C(=O)O