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Lobaric acid dimethylated dervative
SpectraBase Compound ID 8ViyDpp3ry
InChI InChI=1S/C28H36O9/c1-7-9-11-12-18-24(27(31)35-5)21(30)16-23(34-4)26(18)37-22-15-17(33-3)14-19(20(29)13-10-8-2)25(22)28(32)36-6/h14-16,30H,7-13H2,1-6H3
InChIKey UTVHEFUPEGBOFD-UHFFFAOYSA-N
Mol Weight 516.6 g/mol
Molecular Formula C28H36O9
Exact Mass 516.235933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jwzpPA7pnx
Name Lobaric acid dimethylated dervative
Alternate Name(s) 2-[3'-Methoxy-5'-pentanoyl-6'-(methoxycarbonyl)phenyl[-2'-[2''-methoxy-4''-hydroxy-5''-(methoxycarbonyl)-6''-pentylphenyl]oxide 2-[3'-Methoxy-5'-pentanoyl-6'-(methoxycarbonyl)phenyl][2'-[2''-methoxy-4''-hydroxy-5''-(methoxycarbonyl)-6''-pentylphenyl]oxide Lobaric acid dimethylated derivative Lobaric acid-trimethylated derivative
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Formula C28H36O9
InChI InChI=1S/C28H36O9/c1-7-9-11-12-18-24(27(31)35-5)21(30)16-23(34-4)26(18)37-22-15-17(33-3)14-19(20(29)13-10-8-2)25(22)28(32)36-6/h14-16,30H,7-13H2,1-6H3
InChIKey UTVHEFUPEGBOFD-UHFFFAOYSA-N
Molecular Weight 516.587 g/mol
SMILES Oc1cc(c(c(c1C(=O)OC)CCCCC)Oc1c(c(C(=O)CCCC)cc(c1)OC)C(=O)OC)OC
SPLASH splash10-014i-0269440000-7c55e08a082e9ed56b2f
Source of Spectrum Y4-91-465-4
Wiley ID 1550567