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3-(2-chloro-6-fluorobenzyl)-7-hydroxy-4-propylcoumarin, o-chlorobenzoate
SpectraBase Compound ID 38MH8EkI3Sy
InChI InChI=1S/C26H19Cl2FO4/c1-2-6-16-17-12-11-15(32-25(30)18-7-3-4-8-21(18)27)13-24(17)33-26(31)19(16)14-20-22(28)9-5-10-23(20)29/h3-5,7-13H,2,6,14H2,1H3
InChIKey DQPVOSZESBUUDB-UHFFFAOYSA-N
Mol Weight 485.34 g/mol
Molecular Formula C26H19Cl2FO4
Exact Mass 484.064443 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HniLTPYXSGn
Name 3-(2-chloro-6-fluorobenzyl)-7-hydroxy-4-propylcoumarin, o-chlorobenzoate
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Formula C26H19Cl2FO4
InChI InChI=1S/C26H19Cl2FO4/c1-2-6-16-17-12-11-15(32-25(30)18-7-3-4-8-21(18)27)13-24(17)33-26(31)19(16)14-20-22(28)9-5-10-23(20)29/h3-5,7-13H,2,6,14H2,1H3
InChIKey DQPVOSZESBUUDB-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 57020M
Solvent Polysol