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[5R-(5-ALPHA,6-ALPHA)]-5,6,7,8-TETRAHYDRO-7-METHYLIDENE-8-OXO-5-(3,4,5-TRIMETHOXYPHENYL)-NAPHTHO-[2,3-D]-[1,3]-DIOXOLE-6-CARBOCYLIC-ACID

View entire compound with spectra: 1 NMR, and 1 MS (GC)

[5R-(5-ALPHA,6-ALPHA)]-5,6,7,8-TETRAHYDRO-7-METHYLIDENE-8-OXO-5-(3,4,5-TRIMETHOXYPHENYL)-NAPHTHO-[2,3-D]-[1,3]-DIOXOLE-6-CARBOCYLIC-ACID
SpectraBase Compound ID 3xJpKsf5f4B
InChI InChI=1S/C22H20O8/c1-10-18(22(24)25)19(11-5-16(26-2)21(28-4)17(6-11)27-3)12-7-14-15(30-9-29-14)8-13(12)20(10)23/h5-8,18-19H,1,9H2,2-4H3,(H,24,25)/t18-,19+/m0/s1
InChIKey HLSXUNBUCPHTDA-RBUKOAKNSA-N
Mol Weight 412.39 g/mol
Molecular Formula C22H20O8
Exact Mass 412.115818 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tzYFcsmMKx
Name (7R,8R)-5-keto-6-methylene-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylic acid
Alternate Name(s) (7R,8R)-6-methylene-5-oxo-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylic acid (7R,8R)-6-methylidene-5-oxidanylidene-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylic acid (7R,8R)-6-methylidene-5-oxo-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylic acid
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Formula C22H20O8
InChI InChI=1S/C22H20O8/c1-10-18(22(24)25)19(11-5-16(26-2)21(28-4)17(6-11)27-3)12-7-14-15(30-9-29-14)8-13(12)20(10)23/h5-8,18-19H,1,9H2,2-4H3,(H,24,25)/t18-,19+/m0/s1
InChIKey HLSXUNBUCPHTDA-RBUKOAKNSA-N
Molecular Weight 412.394 g/mol
SMILES OC([C@]1(C(C(c2c(cc3c(c2)OCO3)[C@]1(c1cc(OC)c(c(c1)OC)OC)[H])=O)=C)[H])=O
SPLASH splash10-02t9-0109300000-da5490c234fa62eaaca2
Source of Spectrum H-77-776-8
Wiley ID 1374396