| SpectraBase Compound ID | 4UAIr1eZPA3 |
|---|---|
| InChI | InChI=1S/C17H19F5N2O2/c1-3-24(4-2)9-8-11-10-23-12-6-5-7-13(14(11)12)26-15(25)16(18,19)17(20,21)22/h5-7,10,23H,3-4,8-9H2,1-2H3 |
| InChIKey | UVKZCGVOZSSJFG-UHFFFAOYSA-N |
| Mol Weight | 378.34 g/mol |
| Molecular Formula | C17H19F5N2O2 |
| Exact Mass | 378.136669 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GwKC0TCUYqb |
|---|---|
| Name | N,N-Diethyl-4-hydroxytryptamine pfp |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 378.136668673 u |
| Formula | C17H19F5N2O2 |
| InChI | InChI=1S/C17H19F5N2O2/c1-3-24(4-2)9-8-11-10-23-12-6-5-7-13(14(11)12)26-15(25)16(18,19)17(20,21)22/h5-7,10,23H,3-4,8-9H2,1-2H3 |
| InChIKey | UVKZCGVOZSSJFG-UHFFFAOYSA-N |
| Molecular Weight | 378.343 g/mol |
| SMILES | C=12C(NC=C2CCN(CC)CC)=CC=CC1OC(C(C(F)(F)F)(F)F)=O |