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4-(2-(5,6-Dimethylxanthone-4-yl)acetamido)ethyl benzoate
SpectraBase Compound ID 7emdM5w1jy5
InChI InChI=1S/C26H23NO5/c1-4-31-26(30)17-9-11-19(12-10-17)27-22(28)14-18-6-5-7-20-23(29)21-13-8-15(2)16(3)24(21)32-25(18)20/h5-13H,4,14H2,1-3H3,(H,27,28)
InChIKey SEYKSWUDGDQQPI-UHFFFAOYSA-N
Mol Weight 429.47 g/mol
Molecular Formula C26H23NO5
Exact Mass 429.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FdHuWE2QEJ7
Name 4-(2-(5,6-Dimethylxanthone-4-yl)acetamido)ethyl benzoate
Appearance White solid
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Formula C26H23NO5
InChI InChI=1S/C26H23NO5/c1-4-31-26(30)17-9-11-19(12-10-17)27-22(28)14-18-6-5-7-20-23(29)21-13-8-15(2)16(3)24(21)32-25(18)20/h5-13H,4,14H2,1-3H3,(H,27,28)
InChIKey SEYKSWUDGDQQPI-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 429.472 g/mol
Reported Formula C26H23NO5
SMILES N(C(Cc1cccc2C(c3ccc(c(c3Oc12)C)C)=O)=O)c1ccc(cc1)C(=O)OCC
SPLASH splash10-02br-0490400000-aaec3732cc7477855c76
Source of Spectrum CN102786509A
Wiley ID 1846581