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Benzoic acid, 4,5-dimethoxy-2-[[2-(9H-xanthen-9-yl)acetyl]amino]-, methyl ester
SpectraBase Compound ID DHCcZM9HtHB
InChI InChI=1S/C25H23NO6/c1-29-22-12-18(25(28)31-3)19(14-23(22)30-2)26-24(27)13-17-15-8-4-6-10-20(15)32-21-11-7-5-9-16(17)21/h4-12,14,17H,13H2,1-3H3,(H,26,27)
InChIKey KLLFGQNNXCMLMS-UHFFFAOYSA-N
Mol Weight 433.46 g/mol
Molecular Formula C25H23NO6
Exact Mass 433.152537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID y2ZhBcTZo
Name Benzoic acid, 4,5-dimethoxy-2-[[2-(9H-xanthen-9-yl)acetyl]amino]-, methyl ester
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Formula C25H23NO6
InChI InChI=1S/C25H23NO6/c1-29-22-12-18(25(28)31-3)19(14-23(22)30-2)26-24(27)13-17-15-8-4-6-10-20(15)32-21-11-7-5-9-16(17)21/h4-12,14,17H,13H2,1-3H3,(H,26,27)
InChIKey KLLFGQNNXCMLMS-UHFFFAOYSA-N
Molecular Weight 433.460 g/mol
SMILES N(c1c(cc(c(OC)c1)OC)C(=O)OC)C(CC1c2c(cccc2)Oc2c1cccc2)=O
SPLASH splash10-01q9-3940000000-f7d70957789faf8abd4b
Source of Spectrum IY-2-5155-1
Synonyms Methyl 4,5-dimethoxy-2-[2-(9H-xanthen-9-yl)acetamido]benzoate 4,5-Dimethoxy-2-[[1-oxo-2-(9H-xanthen-9-yl)ethyl]amino]benzoic acid methyl ester Methyl 4,5-dimethoxy-2-[[2-(9H-xanthen-9-yl)acetyl]amino]benzoate Methyl 4,5-dimethoxy-2-[2-(9H-xanthen-9-yl)ethanoylamino]benzoate
Wiley ID 1659534