| SpectraBase Compound ID | HRAUA6qhosu |
|---|---|
| InChI | InChI=1S/C41H46ClN4O7P/c1-4-51-54(49,43-27-31-20-22-35(23-21-31)45(3)25-24-42)53-36-26-38(46-28-30(2)39(47)44-40(46)48)52-37(36)29-50-41(32-14-8-5-9-15-32,33-16-10-6-11-17-33)34-18-12-7-13-19-34/h5-23,28,36-38H,4,24-27,29H2,1-3H3,(H,43,49)(H,44,47,48)/t36-,37+,38+,54?/m0/s1 |
| InChIKey | IANVCHSYMALMES-VPJZQFIISA-N |
| Mol Weight | 773.3 g/mol |
| Molecular Formula | C41H46ClN4O7P |
| Exact Mass | 772.279265 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JkrqufkVJpo |
|---|---|
| Name | 5'-O-TRITYLTHYMIDINE-3'-ETHYL(PARA-N-METHYL-N-(2-CHLOROETHYL)AMINOBENZYLAMIDO)PHOSPHATE (DIASTEREOMER MIXTURE) |
| Comments | , 31P-{1H} |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C41H46ClN4O7P |
| InChI | InChI=1S/C41H46ClN4O7P/c1-4-51-54(49,43-27-31-20-22-35(23-21-31)45(3)25-24-42)53-36-26-38(46-28-30(2)39(47)44-40(46)48)52-37(36)29-50-41(32-14-8-5-9-15-32,33-16-10-6-11-17-33)34-18-12-7-13-19-34/h5-23,28,36-38H,4,24-27,29H2,1-3H3,(H,43,49)(H,44,47,48)/t36-,37+,38+,54?/m0/s1 |
| InChIKey | IANVCHSYMALMES-VPJZQFIISA-N |
| Instrument Name | Bruker HX-90 |
| Literature Reference | A.S.LEVINA, E.M.IVANOVA (1985) Bioorganich.Khim.(Russ. Lang.): v.11, N2, 231-238. |
| NMR Standard | H3PO4 85% |
| Observed nucleus | 31P |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | C5H5N pyridine |