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KBYUJTLQXUVPQI-STGLZICKSA-N
SpectraBase Compound ID NoVCf2uF0R
InChI InChI=1S/C29H30F6N4OS/c1-3-16-15-39-9-7-17(16)10-25(39)26(22-6-8-36-24-5-4-21(40-2)14-23(22)24)38-27(41)37-20-12-18(28(30,31)32)11-19(13-20)29(33,34)35/h4-6,8,11-14,16-17,25-26H,3,7,9-10,15H2,1-2H3,(H2,37,38,41)/t16?,17?,25?,26-/m0/s1
InChIKey KBYUJTLQXUVPQI-STGLZICKSA-N
Mol Weight 596.64 g/mol
Molecular Formula C29H30F6N4OS
Exact Mass 596.204452 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BkLssoo7CbF
Name KBYUJTLQXUVPQI-STGLZICKSA-N
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H30F6N4OS
InChI InChI=1S/C29H30F6N4OS/c1-3-16-15-39-9-7-17(16)10-25(39)26(22-6-8-36-24-5-4-21(40-2)14-23(22)24)38-27(41)37-20-12-18(28(30,31)32)11-19(13-20)29(33,34)35/h4-6,8,11-14,16-17,25-26H,3,7,9-10,15H2,1-2H3,(H2,37,38,41)/t16?,17?,25?,26-/m0/s1
InChIKey KBYUJTLQXUVPQI-STGLZICKSA-N
Literature Reference Author B.VAKULYA,S.VARGA,A.CSAMPAI,T.SOOS
Literature Reference Citation ORG.LETTERS,7,1967(2005)
Literature Reference DOI 10.1021/ol050431s
Solvent CD3OD
Source File Reference UWLU62075