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(1-S,4-R,5-S,8-R,9-R,10-S,12-S,13-S)-10-BROMO-1,5,9-TRIMETHYL-10-(TRIFLUOROMETHYL)-11,14,15,16-TETRACYCLO-[10.3.1.0-(4.13).0-(8.13)]-HEXADECANE

View entire compound with spectra: 2 NMR

(1-S,4-R,5-S,8-R,9-R,10-S,12-S,13-S)-10-BROMO-1,5,9-TRIMETHYL-10-(TRIFLUOROMETHYL)-11,14,15,16-TETRACYCLO-[10.3.1.0-(4.13).0-(8.13)]-HEXADECANE
SpectraBase Compound ID 1zU8DH37Csd
InChI InChI=1S/C16H22BrF3O4/c1-8-4-5-11-9(2)15(17,16(18,19)20)22-12-14(11)10(8)6-7-13(3,21-12)23-24-14/h8-12H,4-7H2,1-3H3/t8-,9-,10+,11+,12+,13-,14-,15-/m1/s1
InChIKey KCBATTAHFCLYTC-ISOSDAIHSA-N
Mol Weight 415.25 g/mol
Molecular Formula C16H22BrF3O4
Exact Mass 414.065357 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LXhUsyohw3N
Name (1-S,4-R,5-S,8-R,9-R,10-S,12-S,13-S)-10-BROMO-1,5,9-TRIMETHYL-10-(TRIFLUOROMETHYL)-11,14,15,16-TETRACYCLO-[10.3.1.0-(4.13).0-(8.13)]-HEXADECANE
Compound Number 7B
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22BrF3O4
InChI InChI=1S/C16H22BrF3O4/c1-8-4-5-11-9(2)15(17,16(18,19)20)22-12-14(11)10(8)6-7-13(3,21-12)23-24-14/h8-12H,4-7H2,1-3H3/t8-,9-,10+,11+,12+,13-,14-,15-/m1/s1
InChIKey KCBATTAHFCLYTC-ISOSDAIHSA-N
Literature Reference Author F.CHORKI,F.GRELLEPOIS,B.VROUSSE,V.D.HOANG,N.V.HUNG,D.BONNET- DELPON,J.P.BEGUE
Literature Reference Citation ORG.LETTERS,4,757(2002)
Literature Reference DOI 10.1021/ol017227z
Solvent HET
Source File Reference UWMZ25702