| SpectraBase Compound ID | CQiqflEP1uF |
|---|---|
| InChI | InChI=1S/C17H19N3O.CH4O3S/c1-13-5-7-14(8-6-13)20(12-17-18-9-10-19-17)15-3-2-4-16(21)11-15;1-5(2,3)4/h2-8,11,21H,9-10,12H2,1H3,(H,18,19);1H3,(H,2,3,4) |
| InChIKey | OGIYDFVHFQEFKQ-UHFFFAOYSA-N |
| Mol Weight | 377.46 g/mol |
| Molecular Formula | C18H23N3O4S |
| Exact Mass | 377.140927 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | KEnRCnFKD65 |
|---|---|
| Name | Phentolamine methanesulfonate salt |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 361658 |
| CAS Registry Number | 65-28-1 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H23N3O4S |
| InChI | InChI=1S/C17H19N3O.CH4O3S/c1-13-5-7-14(8-6-13)20(12-17-18-9-10-19-17)15-3-2-4-16(21)11-15;1-5(2,3)4/h2-8,11,21H,9-10,12H2,1H3,(H,18,19);1H3,(H,2,3,4) |
| InChIKey | OGIYDFVHFQEFKQ-UHFFFAOYSA-N |
| Observed nucleus | 13C |
| Purity | 99% |
| Solvent | DMSO-d6 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Synonyms | 2-(N-[m-Hydroxyphenyl]-p-toluidinomethyl)imidazoline |
| Wiley ID | SIAL_13CNMR_007532 |