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1,3-Benzenediol, o-propoxycarbonyl-o'-(2-trifluoromethylbenzoyl)-

View entire compound with spectra: 1 NMR

1,3-Benzenediol, o-propoxycarbonyl-o'-(2-trifluoromethylbenzoyl)-
SpectraBase Compound ID Cg3dJwFyP1Y
InChI InChI=1S/C18H15F3O5/c1-2-10-24-17(23)26-13-7-5-6-12(11-13)25-16(22)14-8-3-4-9-15(14)18(19,20)21/h3-9,11H,2,10H2,1H3
InChIKey SNPFOHWFUNSQFV-UHFFFAOYSA-N
Mol Weight 368.31 g/mol
Molecular Formula C18H15F3O5
Exact Mass 368.087158 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Api2NRXVA3
Name 1,3-Benzenediol, o-propoxycarbonyl-o'-(2-trifluoromethylbenzoyl)-
Comments Computed using HOSE algorithm
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Exact Mass 368.087158067 u
Formula C18H15F3O5
InChI InChI=1S/C18H15F3O5/c1-2-10-24-17(23)26-13-7-5-6-12(11-13)25-16(22)14-8-3-4-9-15(14)18(19,20)21/h3-9,11H,2,10H2,1H3
InChIKey SNPFOHWFUNSQFV-UHFFFAOYSA-N
Molecular Weight 368.308 g/mol
SMILES C1(=CC=CC(=C1)OC(C1=CC=CC=C1C(F)(F)F)=O)OC(=O)OCCC