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Nidulalin A Triacetate
SpectraBase Compound ID 9lV6rCDnS6W
InChI InChI=1S/C22H20O9/c1-11-9-17(30-13(3)24)20(18(10-11)31-14(4)25)21(26)15-7-6-8-16(29-12(2)23)19(15)22(27)28-5/h6-10H,1-5H3
InChIKey RBPSMRRAMCZPDT-UHFFFAOYSA-N
Mol Weight 428.39 g/mol
Molecular Formula C22H20O9
Exact Mass 428.110732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4U5Hvf5qS9U
Name Nidulalin A Triacetate
Alternate Name(s) 2-Acetyloxy-6-[(2,6-diacetyloxy-4-methylphenyl)-oxomethyl]benzoic acid methyl ester Methyl 2-acetyloxy-6-(2,6-diacetyloxy-4-methylbenzoyl)benzoate Methyl 2-acetoxy-6-(2,6-diacetoxy-4-methyl-benzoyl)benzoate Methyl 2-acetyloxy-6-(2,6-diacetyloxy-4-methyl-phenyl)carbonyl-benzoate
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Formula C22H20O9
InChI InChI=1S/C22H20O9/c1-11-9-17(30-13(3)24)20(18(10-11)31-14(4)25)21(26)15-7-6-8-16(29-12(2)23)19(15)22(27)28-5/h6-10H,1-5H3
InChIKey RBPSMRRAMCZPDT-UHFFFAOYSA-N
Molecular Weight 428.393 g/mol
SMILES c1(C(c2c(c(OC(=O)C)ccc2)C(=O)OC)=O)c(OC(=O)C)cc(cc1OC(=O)C)C
SPLASH splash10-00di-0095000000-3927ec18bb7912f03f5e
Source of Spectrum E1-42-1723-4
Wiley ID 1552780