| SpectraBase Compound ID | 1tDfb2rL4ca |
|---|---|
| InChI | InChI=1S/C42H42N3O6P3/c1-31-7-19-37(20-8-31)46-52(47-38-21-9-32(2)10-22-38)43-53(48-39-23-11-33(3)12-24-39,49-40-25-13-34(4)14-26-40)45-54(44-52,50-41-27-15-35(5)16-28-41)51-42-29-17-36(6)18-30-42/h7-30H,1-6H3 |
| InChIKey | QELCMYKEJZINGE-UHFFFAOYSA-N |
| Mol Weight | 777.7 g/mol |
| Molecular Formula | C42H42N3O6P3 |
| Exact Mass | 777.228647 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9WyIZ240uhb |
|---|---|
| Name | 1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexahydro-2,2,4,4,6,6-hexakis(4-methylphenoxy)- |
| CAS Registry Number | 27122-73-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C42H42N3O6P3 |
| InChI | InChI=1S/C42H42N3O6P3/c1-31-7-19-37(20-8-31)46-52(47-38-21-9-32(2)10-22-38)43-53(48-39-23-11-33(3)12-24-39,49-40-25-13-34(4)14-26-40)45-54(44-52,50-41-27-15-35(5)16-28-41)51-42-29-17-36(6)18-30-42/h7-30H,1-6H3 |
| InChIKey | QELCMYKEJZINGE-UHFFFAOYSA-N |
| Molecular Weight | 777.734 g/mol |
| SMILES | Cc1ccc(Op2(Oc3ccc(C)cc3)np(Oc3ccc(C)cc3)(Oc3ccc(C)cc3)np(Oc3ccc(C)cc3)(Oc3ccc(C)cc3)n2)cc1 |
| SPLASH | splash10-00fr-0000009700-77802a7b3cc156d323e4 |
| Source of Spectrum | O-20-166-2 |
| Wiley ID | 1416839 |