| SpectraBase Compound ID | 4tmbW2A7Y5e |
|---|---|
| InChI | InChI=1S/C33H34NO3P.CH4O3S/c35-31-22-20-27(26-32(31)36)21-23-33(37)34-24-12-1-2-13-25-38(28-14-6-3-7-15-28,29-16-8-4-9-17-29)30-18-10-5-11-19-30;1-5(2,3)4/h3-11,14-23,26H,1-2,12-13,24-25H2,(H2-,34,35,36,37);1H3,(H,2,3,4) |
| InChIKey | GBBQRIPKVMMHGC-UHFFFAOYSA-N |
| Mol Weight | 619.71 g/mol |
| Molecular Formula | C34H38NO6PS |
| Exact Mass | 619.215746 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FBRXQEelcPO |
|---|---|
| Name | (E)-(6-(3-(3,4-dihydroxyphenyl)prop-2-enamido)hexyl)triphenylphosphonium methanesulfonate |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H38NO6PS |
| InChI | InChI=1S/C33H34NO3P.CH4O3S/c35-31-22-20-27(26-32(31)36)21-23-33(37)34-24-12-1-2-13-25-38(28-14-6-3-7-15-28,29-16-8-4-9-17-29)30-18-10-5-11-19-30;1-5(2,3)4/h3-11,14-23,26H,1-2,12-13,24-25H2,(H2-,34,35,36,37);1H3,(H,2,3,4) |
| InChIKey | GBBQRIPKVMMHGC-UHFFFAOYSA-N |
| Instrument Name | Varian 320-MS |
| Ionization Type | EI |
| Molecular Weight | 619.713 g/mol |
| SMILES | N(C(\C=C\c1cc(c(cc1)O)O)=O)CCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.CS([O-])(=O)=O |
| SPLASH | splash10-03e9-0690000000-1a6dcea9ada6fb5f10d7 |
| Source of Spectrum | WO2018069904A1 |
| Wiley ID | 1866244 |