| SpectraBase Compound ID | 6VsybmFk3EQ |
|---|---|
| InChI | InChI=1S/C18H25F3N2O3/c1-5-23(6-2)11-17(3,4)12-26-15(24)13-7-9-14(10-8-13)22-16(25)18(19,20)21/h7-10H,5-6,11-12H2,1-4H3,(H,22,25) |
| InChIKey | MEVLNRQYVBICOH-UHFFFAOYSA-N |
| Mol Weight | 374.4 g/mol |
| Molecular Formula | C18H25F3N2O3 |
| Exact Mass | 374.181727 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 46ryPmlgjem |
|---|---|
| Name | Dimethocaine tfa |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 374.181727159 u |
| Formula | C18H25F3N2O3 |
| InChI | InChI=1S/C18H25F3N2O3/c1-5-23(6-2)11-17(3,4)12-26-15(24)13-7-9-14(10-8-13)22-16(25)18(19,20)21/h7-10H,5-6,11-12H2,1-4H3,(H,22,25) |
| InChIKey | MEVLNRQYVBICOH-UHFFFAOYSA-N |
| Molecular Weight | 374.404 g/mol |
| SMILES | C(NC1=CC=C(C(OCC(CN(CC)CC)(C)C)=O)C=C1)(C(F)(F)F)=O |