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2-[(2',3'-Dihydro-2'-oxo-1H-indol-3'-yl)(2",5"-dimethoxyphenyl)methyl]malonic acid
SpectraBase Compound ID Dw1uilC41ms
InChI InChI=1S/C20H19NO7/c1-27-10-7-8-14(28-2)12(9-10)15(17(19(23)24)20(25)26)16-11-5-3-4-6-13(11)21-18(16)22/h3-9,15-17H,1-2H3,(H,21,22)(H,23,24)(H,25,26)
InChIKey IAGJIXNZZFXJIQ-UHFFFAOYSA-N
Mol Weight 385.37 g/mol
Molecular Formula C20H19NO7
Exact Mass 385.116152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CVCfBvlzWVc
Name 2-[(2',3'-Dihydro-2'-oxo-1H-indol-3'-yl)(2",5"-dimethoxyphenyl)methyl]malonic acid
Alternate Name(s) 2-[(2,5-dimethoxyphenyl)(2-oxo-2,3-dihydro-1H-indol-3-yl)methyl]malonic acid 2-[(2,5-dimethoxyphenyl)-(2-oxo-1,3-dihydroindol-3-yl)methyl]propanedioic acid 2-[(2,5-dimethoxyphenyl)-(2-oxoindolin-3-yl)methyl]propanedioic acid 2-[(2,5-dimethoxyphenyl)-(2-oxidanylidene-1,3-dihydroindol-3-yl)methyl]propanedioic acid
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Formula C20H19NO7
InChI InChI=1S/C20H19NO7/c1-27-10-7-8-14(28-2)12(9-10)15(17(19(23)24)20(25)26)16-11-5-3-4-6-13(11)21-18(16)22/h3-9,15-17H,1-2H3,(H,21,22)(H,23,24)(H,25,26)
InChIKey IAGJIXNZZFXJIQ-UHFFFAOYSA-N
Molecular Weight 385.372 g/mol
SMILES OC(C(C(=O)O)C(C1C(Nc2ccccc12)=O)c1c(ccc(c1)OC)OC)=O
SPLASH splash10-001i-0029000000-d0c07f15b0083b99ff58
Source of Spectrum U1-2002-3486-13
Wiley ID 1523367