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5-O-(3'-O-THYMIDYL)-METHYL-3-O-BENZOYL-THYMIDINE
SpectraBase Compound ID 16FpbAJP6cY
InChI InChI=1S/C28H32N4O11/c1-15-10-31(27(37)29-24(15)34)22-8-18(20(12-33)41-22)40-14-39-13-21-19(43-26(36)17-6-4-3-5-7-17)9-23(42-21)32-11-16(2)25(35)30-28(32)38/h3-7,10-11,18-23,33H,8-9,12-14H2,1-2H3,(H,29,34,37)(H,30,35,38)/t18-,19+,20+,21-,22+,23-/m0/s1
InChIKey GIJTUBMYPFLNIM-PQBVEICXSA-N
Mol Weight 600.6 g/mol
Molecular Formula C28H32N4O11
Exact Mass 600.206758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BNZV2O62rye
Name 5-O-(3'-O-THYMIDYL)-METHYL-3-O-BENZOYL-THYMIDINE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H32N4O11
InChI InChI=1S/C28H32N4O11/c1-15-10-31(27(37)29-24(15)34)22-8-18(20(12-33)41-22)40-14-39-13-21-19(43-26(36)17-6-4-3-5-7-17)9-23(42-21)32-11-16(2)25(35)30-28(32)38/h3-7,10-11,18-23,33H,8-9,12-14H2,1-2H3,(H,29,34,37)(H,30,35,38)/t18-,19+,20+,21-,22+,23-/m0/s1
InChIKey GIJTUBMYPFLNIM-PQBVEICXSA-N
Literature Reference Author P.J.L.M.QUAEDFLIEG,J.A.PIKKEMAAT,G.A.VANDERMAREL,E.KUYL-YEHE SKIELY,C.ALTONA,J.H.
Literature Reference Citation REC.TR.CH.P.-B.,112,15(1993)
Literature Reference DOI 10.1002/recl.19931120104
Molecular Weight 600.582 g/mol
Solvent CDCl3
Source File Reference UWRK1635