SpectraBase Compound ID | D8rL2j7DEYy |
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InChI | InChI=1S/C21H29N4O11PS/c1-9-6-24-14-4-10(27)13(35-14)8-33-37(31,32)36-11-5-15(34-12(11)7-26)25-16-20(2,17(28)22-18(25)29)38-21(9,16)23(3)19(24)30/h6,10-16,26-27H,4-5,7-8H2,1-3H3,(H,31,32)(H,22,28,29)/t10-,11-,12+,13+,14+,15+,16-,20-,21?/m1/s1 |
InChIKey | HITKOXMPEMJQTL-JJVGJODDSA-N |
Mol Weight | 576.51 g/mol |
Molecular Formula | C21H29N4O11PS |
Exact Mass | 576.129116 g/mol |
SpectraBase Spectrum ID | DPfBHRTDtmz |
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Name | HITKOXMPEMJQTL-JJVGJODDSA-N |
Compound Number | 13A |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C21H28N4O11PS |
InChI | InChI=1S/C21H29N4O11PS/c1-9-6-24-14-4-10(27)13(35-14)8-33-37(31,32)36-11-5-15(34-12(11)7-26)25-16-20(2,17(28)22-18(25)29)38-21(9,16)23(3)19(24)30/h6,10-16,26-27H,4-5,7-8H2,1-3H3,(H,31,32)(H,22,28,29)/t10-,11-,12+,13+,14+,15+,16-,20-,21?/m1/s1 |
InChIKey | HITKOXMPEMJQTL-JJVGJODDSA-N |
Literature Reference Author | P.CLIVIO,J.L.FOURREY,T.SZABO,J.STAWINSKI |
Literature Reference Citation | J.ORG.CHEM.,59,7273(1994) |
Literature Reference DOI | 10.1021/jo00103a018 |
Solvent | D2O |
Source File Reference | UWCS24102 |