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LBTCGHBYPDISON-UHFFFAOYSA-O
SpectraBase Compound ID GIazRRkEcOb
InChI InChI=1S/C26H44F3N5O3/c1-7-25(6,32-22(35)20(15-18(4)5)31-24(37)26(27,28)29)23(36)30-19(14-17(2)3)16-34-13-9-12-33-11-8-10-21(33)34/h17-20H,7-16H2,1-6H3,(H2-,30,31,32,35,36,37)/p+1
InChIKey LBTCGHBYPDISON-UHFFFAOYSA-O
Mol Weight 532.7 g/mol
Molecular Formula C26H45F3N5O3
Exact Mass 532.34745 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LyRzv7mTYSY
Name LBTCGHBYPDISON-UHFFFAOYSA-O
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H45F3N5O3
InChI InChI=1S/C26H44F3N5O3/c1-7-25(6,32-22(35)20(15-18(4)5)31-24(37)26(27,28)29)23(36)30-19(14-17(2)3)16-34-13-9-12-33-11-8-10-21(33)34/h17-20H,7-16H2,1-6H3,(H2-,30,31,32,35,36,37)/p+1
InChIKey LBTCGHBYPDISON-UHFFFAOYSA-O
Literature Reference Author S.GUPTA,S.B.KRASNOFF,D.W.ROBERTS,J.A.A.RENWICK,L.S.BRINEN,J. CLARDY
Literature Reference Citation J.ORG.CHEM.,57,2306(1992)
Literature Reference DOI 10.1021/jo00034a022
Molecular Weight 532.670 g/mol
Solvent CD3OD
Source File Reference UWCS1979