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Glutaric acid, 1,1,1-trifluoroprop-2-yl 4-methoxybenzyl ester

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Glutaric acid, 1,1,1-trifluoroprop-2-yl 4-methoxybenzyl ester
SpectraBase Compound ID Cqbvqsmf8Z9
InChI InChI=1S/C16H19F3O5/c1-11(16(17,18)19)24-15(21)5-3-4-14(20)23-10-12-6-8-13(22-2)9-7-12/h6-9,11H,3-5,10H2,1-2H3
InChIKey OVPJNYAQFNRYRP-UHFFFAOYSA-N
Mol Weight 348.32 g/mol
Molecular Formula C16H19F3O5
Exact Mass 348.118458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3eLqmatyJcy
Name Glutaric acid, 1,1,1-trifluoroprop-2-yl 4-methoxybenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 348.118458196 u
Formula C16H19F3O5
InChI InChI=1S/C16H19F3O5/c1-11(16(17,18)19)24-15(21)5-3-4-14(20)23-10-12-6-8-13(22-2)9-7-12/h6-9,11H,3-5,10H2,1-2H3
InChIKey OVPJNYAQFNRYRP-UHFFFAOYSA-N
Molecular Weight 348.318 g/mol
SMILES C(CCC(OC(C)C(F)(F)F)=O)C(OCC1=CC=C(C=C1)OC)=O