| SpectraBase Compound ID | Ed7NKTrkRJT |
|---|---|
| InChI | InChI=1S/C38H40N3O7P/c1-3-46-49(44,39-25-29-16-8-4-9-17-29)48-33-24-35(41-26-28(2)36(42)40-37(41)43)47-34(33)27-45-38(30-18-10-5-11-19-30,31-20-12-6-13-21-31)32-22-14-7-15-23-32/h4-23,26,33-35H,3,24-25,27H2,1-2H3,(H,39,44)(H,40,42,43)/t33-,34+,35+,49?/m0/s1 |
| InChIKey | BHJSLRDKWWCITB-KBUNAWGSSA-N |
| Mol Weight | 681.7 g/mol |
| Molecular Formula | C38H40N3O7P |
| Exact Mass | 681.260388 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H6tXVHTIbiu |
|---|---|
| Name | 5'-O-TRITYLDEOXYTHYMIDINE-3'-ETHYL(BENZYLAMIDO)PHOSPHATE (DIASTEREOMERMIXTURE) |
| Comments | , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C38H40N3O7P |
| InChI | InChI=1S/C38H40N3O7P/c1-3-46-49(44,39-25-29-16-8-4-9-17-29)48-33-24-35(41-26-28(2)36(42)40-37(41)43)47-34(33)27-45-38(30-18-10-5-11-19-30,31-20-12-6-13-21-31)32-22-14-7-15-23-32/h4-23,26,33-35H,3,24-25,27H2,1-2H3,(H,39,44)(H,40,42,43)/t33-,34+,35+,49?/m0/s1 |
| InChIKey | BHJSLRDKWWCITB-KBUNAWGSSA-N |
| Instrument Name | Bruker HX-90 |
| Literature Reference | A.V.LEBEDEV, A.I.REZVUKHIN (1983) Bioorganich.Khim.(Russ. Lang.): v.9, N2, 149-185. |
| NMR Standard | -H3PO4 85% |
| Observed nucleus | 31P |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | C4H8O2 dioxane |