| SpectraBase Compound ID | 6CW7uVmhdt2 |
|---|---|
| InChI | InChI=1S/C70H92O4P2.2CHF3O3S.2H2O.Pd/c1-63(2,3)43-29-44(64(4,5)6)34-51(33-43)75(52-35-45(65(7,8)9)30-46(36-52)66(10,11)12)57-27-25-55-61(73-41-71-55)59(57)60-58(28-26-56-62(60)74-42-72-56)76(53-37-47(67(13,14)15)31-48(38-53)68(16,17)18)54-39-49(69(19,20)21)32-50(40-54)70(22,23)24;2*2-1(3,4)8(5,6)7;;;/h25-40H,41-42H2,1-24H3;2*(H,5,6,7);2*1H2; |
| InChIKey | KMYFNXFPTUMWAF-UHFFFAOYSA-N |
| Mol Weight | 1502.04 g/mol |
| Molecular Formula | C72H98F6O12P2PdS2 |
| Exact Mass | 1500.491394 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 88WjC31ZLuS |
|---|---|
| Name | KMYFNXFPTUMWAF-UHFFFAOYSA-N |
| Compound Number | 1C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C72H96F6O12P2PdS2 |
| InChI | InChI=1S/C70H92O4P2.2CHF3O3S.2H2O.Pd/c1-63(2,3)43-29-44(64(4,5)6)34-51(33-43)75(52-35-45(65(7,8)9)30-46(36-52)66(10,11)12)57-27-25-55-61(73-41-71-55)59(57)60-58(28-26-56-62(60)74-42-72-56)76(53-37-47(67(13,14)15)31-48(38-53)68(16,17)18)54-39-49(69(19,20)21)32-50(40-54)70(22,23)24;2*2-1(3,4)8(5,6)7;;;/h25-40H,41-42H2,1-24H3;2*(H,5,6,7);2*1H2; |
| InChIKey | KMYFNXFPTUMWAF-UHFFFAOYSA-N |
| Literature Reference Author | Y.HAMASHIMA,K.YAGI,H.TAKANO,L.TAMAS,M.SODEOKA |
| Literature Reference Citation | J.AM.CHEM.SOC.,124,14530(2002) |
| Literature Reference DOI | 10.1021/ja028464f |
| Solvent | CDCl3 |
| Source File Reference | UWSI34264 |