| SpectraBase Compound ID | HedDlWwsWwL |
|---|---|
| InChI | InChI=1S/C17H19N6O4PS/c18-15-12-16(20-8-19-15)22(9-21-12)17-14(24)13-11(27-17)7-26-28(25,29)23(13)6-10-4-2-1-3-5-10/h1-5,8-9,11,13-14,17,24H,6-7H2,(H,25,29)(H2,18,19,20)/t11-,13+,14+,17+,28?/m1/s1 |
| InChIKey | QIRVPAGABVBIOT-PIIHGWKCSA-N |
| Mol Weight | 434.41 g/mol |
| Molecular Formula | C17H19N6O4PS |
| Exact Mass | 434.092611 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1zZRsvgwisD |
|---|---|
| Name | QIRVPAGABVBIOT-PIIHGWKCSA-N |
| Compound Number | 17A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H18N6O4PS |
| InChI | InChI=1S/C17H19N6O4PS/c18-15-12-16(20-8-19-15)22(9-21-12)17-14(24)13-11(27-17)7-26-28(25,29)23(13)6-10-4-2-1-3-5-10/h1-5,8-9,11,13-14,17,24H,6-7H2,(H,25,29)(H2,18,19,20)/t11-,13+,14+,17+,28?/m1/s1 |
| InChIKey | QIRVPAGABVBIOT-PIIHGWKCSA-N |
| Literature Reference Author | M.MORR,L.ERNST |
| Literature Reference Citation | CHEM.BER.,111,2152(1978) |
| Literature Reference DOI | 10.1002/cber.19781110612 |
| Molecular Weight | 433.401 g/mol |
| Solvent | D2O,PD=8-10 |
| Source File Reference | UWCS8982 |