| SpectraBase Compound ID | 3fvTgAEuWtp |
|---|---|
| InChI | InChI=1S/C33H34NO4P.CH4O3S/c35-30-24-26(25-31(36)33(30)38)20-21-32(37)34-22-12-1-2-13-23-39(27-14-6-3-7-15-27,28-16-8-4-9-17-28)29-18-10-5-11-19-29;1-5(2,3)4/h3-11,14-21,24-25H,1-2,12-13,22-23H2,(H3-,34,35,36,37,38);1H3,(H,2,3,4) |
| InChIKey | VUGFCAQRAGTWLF-UHFFFAOYSA-N |
| Mol Weight | 635.71 g/mol |
| Molecular Formula | C34H38NO7PS |
| Exact Mass | 635.210661 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1NTnwwq6Isi |
|---|---|
| Name | (E)-(6-(3-(3,4,5-trihydroxyphenyl)prop-2-enamido)hexyl)triphenylphosphonium methanesulfonate |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H38NO7PS |
| InChI | InChI=1S/C33H34NO4P.CH4O3S/c35-30-24-26(25-31(36)33(30)38)20-21-32(37)34-22-12-1-2-13-23-39(27-14-6-3-7-15-27,28-16-8-4-9-17-28)29-18-10-5-11-19-29;1-5(2,3)4/h3-11,14-21,24-25H,1-2,12-13,22-23H2,(H3-,34,35,36,37,38);1H3,(H,2,3,4) |
| InChIKey | VUGFCAQRAGTWLF-UHFFFAOYSA-N |
| Instrument Name | Varian 320-MS |
| Ionization Type | EI |
| Molecular Weight | 635.712 g/mol |
| SMILES | N(C(\C=C\c1cc(c(c(c1)O)O)O)=O)CCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.CS([O-])(=O)=O |
| SPLASH | splash10-001i-9460000000-d174911276cd9692836c |
| Source of Spectrum | WO2018069904A1 |
| Wiley ID | 1866245 |