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2-(4-BROMOBENZYL)-4-(4-FLUOROPHENYL)-4-OXO-2-TRIFLUOROMETHYL-BUTANOIC-ACID
SpectraBase Compound ID 8lbTO4E0ST0
InChI InChI=1S/C18H13BrF4O3/c19-13-5-1-11(2-6-13)9-17(16(25)26,18(21,22)23)10-15(24)12-3-7-14(20)8-4-12/h1-8H,9-10H2,(H,25,26)
InChIKey ZMRWVCYTVAYNRI-UHFFFAOYSA-N
Mol Weight 433.2 g/mol
Molecular Formula C18H13BrF4O3
Exact Mass 431.99842 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1V271yRdz4m
Name 2-(4-BROMOBENZYL)-4-(4-FLUOROPHENYL)-4-OXO-2-TRIFLUOROMETHYL-BUTANOIC-ACID
Compound Number 10
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Formula C18H13BrF4O3
InChI InChI=1S/C18H13BrF4O3/c19-13-5-1-11(2-6-13)9-17(16(25)26,18(21,22)23)10-15(24)12-3-7-14(20)8-4-12/h1-8H,9-10H2,(H,25,26)
InChIKey ZMRWVCYTVAYNRI-UHFFFAOYSA-N
Literature Reference Author K.BURGER,A.FUCHS,L.HENNIG,B.HELMREICH,D.GREIF
Literature Reference Citation MH.CHEM.,132,929(2001)
Literature Reference DOI 10.1007/s007060170056
Molecular Weight 433.197 g/mol
Solvent CDCl3
Source File Reference UWSI3296