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N-(2',3',5'-TRI-O-BENZOYL-BETA-D-RIBOFURANOSYL)-7-ETHYL-3-TRIFLUOROMETHYL-1-NITRO-10H-PHENOTHIAZINE

View entire compound with spectra: 2 NMR

N-(2',3',5'-TRI-O-BENZOYL-BETA-D-RIBOFURANOSYL)-7-ETHYL-3-TRIFLUOROMETHYL-1-NITRO-10H-PHENOTHIAZINE
SpectraBase Compound ID DnrLZFUfcUQ
InChI InChI=1S/C41H31F3N2O9S/c1-2-24-18-19-29-32(20-24)56-33-22-28(41(42,43)44)21-30(46(50)51)34(33)45(29)37-36(55-40(49)27-16-10-5-11-17-27)35(54-39(48)26-14-8-4-9-15-26)31(53-37)23-52-38(47)25-12-6-3-7-13-25/h3-22,31,35-37H,2,23H2,1H3/t31-,35-,36-,37-/m1/s1
InChIKey OIFCWECSCUAOSK-MCNAWRSPSA-N
Mol Weight 784.8 g/mol
Molecular Formula C41H31F3N2O9S
Exact Mass 784.170236 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9aGkRYorwki
Name N-(2',3',5'-TRI-O-BENZOYL-BETA-D-RIBOFURANOSYL)-7-ETHYL-3-TRIFLUOROMETHYL-1-NITRO-10H-PHENOTHIAZINE
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H31F3N2O9S
InChI InChI=1S/C41H31F3N2O9S/c1-2-24-18-19-29-32(20-24)56-33-22-28(41(42,43)44)21-30(46(50)51)34(33)45(29)37-36(55-40(49)27-16-10-5-11-17-27)35(54-39(48)26-14-8-4-9-15-26)31(53-37)23-52-38(47)25-12-6-3-7-13-25/h3-22,31,35-37H,2,23H2,1H3/t31-,35-,36-,37-/m1/s1
InChIKey OIFCWECSCUAOSK-MCNAWRSPSA-N
Literature Reference Author N.GAUTAM,A.YASAV,N.KHANDELWAL,D.C.GAUTAM
Literature Reference Citation J.CHEM.SCI.,126,197(2014)
Literature Reference DOI 10.1007/s12039-013-0551-2
Solvent CDCl3
Source File Reference UWBT11271