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C(6)-O-(TRIFLUOROMETHYL)-BICYCLOMYCIN

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C(6)-O-(TRIFLUOROMETHYL)-BICYCLOMYCIN
SpectraBase Compound ID CGDI9XR4ALq
InChI InChI=1S/C14H19F3N2O7/c1-7-3-4-25-14(8(21)11(2,24)5-20)10(23)18-13(7,9(22)19-14)26-6-12(15,16)17/h8,20-21,24H,1,3-6H2,2H3,(H,18,23)(H,19,22)/t8?,11?,13-,14-/m1/s1
InChIKey GTHJVOGNPOFZDI-VRJOGZBCSA-N
Mol Weight 384.31 g/mol
Molecular Formula C14H19F3N2O7
Exact Mass 384.114435 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DGgFgFBme87
Name C(6)-O-(TRIFLUOROMETHYL)-BICYCLOMYCIN
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H19F3N2O7
InChI InChI=1S/C14H19F3N2O7/c1-7-3-4-25-14(8(21)11(2,24)5-20)10(23)18-13(7,9(22)19-14)26-6-12(15,16)17/h8,20-21,24H,1,3-6H2,2H3,(H,18,23)(H,19,22)/t8?,11?,13-,14-/m1/s1
InChIKey GTHJVOGNPOFZDI-VRJOGZBCSA-N
Literature Reference Author A.SANTILLAN,H.G.PARK,X.ZHANG,O.S.LEE,W.R.WIDGER,H.KOHN
Literature Reference Citation J.ORG.CHEM.,61,7756(1996)
Literature Reference DOI 10.1021/jo961003q
Molecular Weight 384.309 g/mol
Solvent CD3OD
Source File Reference UWCS21852