![N-BENZOYL-5-METHYL-[3',5'-DI-O-ACETYL-2'-O-(2-TRIFLUOROACETAMIDO)-ETHYL-BETA-D-RIBOFURANOSYL]-CYTOSINE](/api/spectrum/4KX2Psf8hCT/structure.png?h=300&w=458 "N-BENZOYL-5-METHYL-[3',5'-DI-O-ACETYL-2'-O-(2-TRIFLUOROACETAMIDO)-ETHYL-BETA-D-RIBOFURANOSYL]-CYTOSINE")
| SpectraBase Compound ID | HlS2QSlAhhY |
|---|---|
| InChI | InChI=1S/C25H27F3N4O9/c1-13-11-32(24(37)31-20(13)30-21(35)16-7-5-4-6-8-16)22-19(38-10-9-29-23(36)25(26,27)28)18(40-15(3)34)17(41-22)12-39-14(2)33/h4-8,11,17-19,22H,9-10,12H2,1-3H3,(H,29,36)(H,30,31,35,37)/t17-,18-,19-,22-/m0/s1 |
| InChIKey | ZCLARCYOYNNYTP-OZIGNCPNSA-N |
| Mol Weight | 584.51 g/mol |
| Molecular Formula | C25H27F3N4O9 |
| Exact Mass | 584.173013 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4KX2Psf8hCT |
|---|---|
| Name | N-BENZOYL-5-METHYL-[3',5'-DI-O-ACETYL-2'-O-(2-TRIFLUOROACETAMIDO)-ETHYL-BETA-D-RIBOFURANOSYL]-CYTOSINE |
| Compound Number | 20 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H27F3N4O9 |
| InChI | InChI=1S/C25H27F3N4O9/c1-13-11-32(24(37)31-20(13)30-21(35)16-7-5-4-6-8-16)22-19(38-10-9-29-23(36)25(26,27)28)18(40-15(3)34)17(41-22)12-39-14(2)33/h4-8,11,17-19,22H,9-10,12H2,1-3H3,(H,29,36)(H,30,31,35,37)/t17-,18-,19-,22-/m0/s1 |
| InChIKey | ZCLARCYOYNNYTP-OZIGNCPNSA-N |
| Literature Reference Author | S.BUCHINI,C.J.LEUMANN |
| Literature Reference Citation | EUR.J.ORG.CHEM.,3152(2006) |
| Molecular Weight | 584.506 g/mol |
| Sample ID | 44140 |
| Solvent | CDCl3 |