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(2-S,3-S)-2-METHYL-3-[(3',4',5'-TRIMETHOXYPHENYL)-(3''-HYDROXY-4'',5''-DIMETHOXYPHENYL)-METHYL]-BUTYROLACTONE
SpectraBase Compound ID 5lYNYX1zEyH
InChI InChI=1S/C23H28O8/c1-12-15(11-31-23(12)25)20(13-7-16(24)21(29-5)17(8-13)26-2)14-9-18(27-3)22(30-6)19(10-14)28-4/h7-10,12,15,20,24H,11H2,1-6H3/t12-,15+,20?/m0/s1
InChIKey AEHBVQHJSNELOD-CAIAHIEYSA-N
Mol Weight 432.47 g/mol
Molecular Formula C23H28O8
Exact Mass 432.178418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hp5tfH6ICZ4
Name (3S,4S)-4-[(3-Hydroxy-4,5-dimethoxy-phenyl)-(3,4,5-trimethoxy-phenyl)-methyl]-3-methyl-dihydro-furan-2-one
Alternate Name(s) 2-Methyl-3-[(3',4',5'-trimethoxyphenyl)(3''-hydroxy-4'',5''-dimethoxyphenyl)methyl]-butyrolactone (3S,4S)-4-[(3-hydroxy-4,5-dimethoxyphenyl)-(3,4,5-trimethoxyphenyl)methyl]-3-methyl-2-oxolanone (3S,4S)-4-[(3-hydroxy-4,5-dimethoxyphenyl)-(3,4,5-trimethoxyphenyl)methyl]-3-methyloxolan-2-one (3S,4S)-4-[(3,4-dimethoxy-5-oxidanyl-phenyl)-(3,4,5-trimethoxyphenyl)methyl]-3-methyl-oxolan-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C23H28O8
InChI InChI=1S/C23H28O8/c1-12-15(11-31-23(12)25)20(13-7-16(24)21(29-5)17(8-13)26-2)14-9-18(27-3)22(30-6)19(10-14)28-4/h7-10,12,15,20,24H,11H2,1-6H3/t12-,15+,20?/m0/s1
InChIKey AEHBVQHJSNELOD-CAIAHIEYSA-N
Molecular Weight 432.469 g/mol
SMILES Oc1c(OC)c(cc(C(c2cc(c(OC)c(c2)OC)OC)[C@]2([C@@](C(=O)OC2)(C)[H])[H])c1)OC
SPLASH splash10-001i-0009200000-95249a3fda75982e74bf
Source of Spectrum G4-69-793-3
Wiley ID 1694330