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2-(5,6-Dimethylxanthone-4-yl)-acetic acid-(4-chlorobenzyl)ester
SpectraBase Compound ID 2eqLqvJLEJD
InChI InChI=1S/C24H19ClO4/c1-14-6-11-20-22(27)19-5-3-4-17(24(19)29-23(20)15(14)2)12-21(26)28-13-16-7-9-18(25)10-8-16/h3-11H,12-13H2,1-2H3
InChIKey KYOMDKYHPAWUPZ-UHFFFAOYSA-N
Mol Weight 406.87 g/mol
Molecular Formula C24H19ClO4
Exact Mass 406.097187 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0bIZIpLjoe
Name 2-(5,6-Dimethylxanthone-4-yl)-acetic acid-(4-chlorobenzyl)ester
Appearance White solid
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Formula C24H19ClO4
InChI InChI=1S/C24H19ClO4/c1-14-6-11-20-22(27)19-5-3-4-17(24(19)29-23(20)15(14)2)12-21(26)28-13-16-7-9-18(25)10-8-16/h3-11H,12-13H2,1-2H3
InChIKey KYOMDKYHPAWUPZ-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 406.865 g/mol
Reported Formula C24H19(35)ClO4
SMILES C(Cc1cccc2C(c3ccc(c(c3Oc12)C)C)=O)(=O)OCc1ccc(cc1)Cl
SPLASH splash10-0540-0090100000-2b07e98ec387f7bc47ed
Source of Spectrum CN102786509A
Wiley ID 1846578