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SHVLXGQTESFXQE-YBFXNURJSA-N
SpectraBase Compound ID 39X1SNlLLA4
InChI InChI=1S/C21H12BrF3/c22-15-9-10-18-16-3-1-2-4-17(16)19(20(18)12-15)11-13-5-7-14(8-6-13)21(23,24)25/h1-12H/b19-11+
InChIKey SHVLXGQTESFXQE-YBFXNURJSA-N
Mol Weight 401.23 g/mol
Molecular Formula C21H12BrF3
Exact Mass 400.007448 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IrijWjoUull
Name SHVLXGQTESFXQE-YBFXNURJSA-N
Compound Number 16E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H12BrF3
InChI InChI=1S/C21H12BrF3/c22-15-9-10-18-16-3-1-2-4-17(16)19(20(18)12-15)11-13-5-7-14(8-6-13)21(23,24)25/h1-12H/b19-11+
InChIKey SHVLXGQTESFXQE-YBFXNURJSA-N
Literature Reference Author R.ANNUNZIATA,V.MOLTENI,L.RAIMONDI
Literature Reference Citation MAGN.RES.CHEM.,36,520(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(199807)36:7<520::aid-omr327>3.0.co;2-7
Molecular Weight 401.225 g/mol
Solvent CDCl3
Source File Reference UWRU1168