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cis-Triethyl 5-(4-bromophenyl)-4-(2,2,2-trifluoroethylidene)tetrahydrofuran-2,3,3-tricarboxylate
SpectraBase Compound ID EEeN0QRrjhF
InChI InChI=1S/C21H22BrF3O7/c1-4-29-17(26)16-21(18(27)30-5-2,19(28)31-6-3)14(11-20(23,24)25)15(32-16)12-7-9-13(22)10-8-12/h7-11,15-16H,4-6H2,1-3H3/b14-11+/t15-,16+/m0/s1
InChIKey WLTIXWRJVNVACL-QNHDLBPPSA-N
Mol Weight 523.3 g/mol
Molecular Formula C21H22BrF3O7
Exact Mass 522.050101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D4MManh3Y
Name cis-Triethyl 5-(4-bromophenyl)-4-(2,2,2-trifluoroethylidene)tetrahydrofuran-2,3,3-tricarboxylate
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Formula C21H22BrF3O7
InChI InChI=1S/C21H22BrF3O7/c1-4-29-17(26)16-21(18(27)30-5-2,19(28)31-6-3)14(11-20(23,24)25)15(32-16)12-7-9-13(22)10-8-12/h7-11,15-16H,4-6H2,1-3H3/b14-11+/t15-,16+/m0/s1
InChIKey WLTIXWRJVNVACL-QNHDLBPPSA-N
Molecular Weight 523.299 g/mol
SMILES C1(\C([C@](c2ccc(cc2)Br)(O[C@@]1(C(=O)OCC)[H])[H])=C\C(F)(F)F)(C(=O)OCC)C(=O)OCC
SPLASH splash10-0f6t-0000910000-41134f0e2c2d3254cab5
Source of Spectrum F-65-1991-3c
Wiley ID 1681521