| SpectraBase Compound ID | J7COBZObcwD |
|---|---|
| InChI | InChI=1S/C22H24FN3O2/c23-17-6-3-5-16(15-17)21(27)9-4-12-25-13-10-18(11-14-25)26-20-8-2-1-7-19(20)24-22(26)28/h1-3,5-8,15,18H,4,9-14H2,(H,24,28) |
| InChIKey | GNWCYKNAKQLBCP-UHFFFAOYSA-N |
| Mol Weight | 381.45 g/mol |
| Molecular Formula | C22H24FN3O2 |
| Exact Mass | 381.185255 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K5J5lSjgWEv |
|---|---|
| Name | Droperidol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 381.185255186 u |
| Formula | C22H24FN3O2 |
| InChI | InChI=1S/C22H24FN3O2/c23-17-6-3-5-16(15-17)21(27)9-4-12-25-13-10-18(11-14-25)26-20-8-2-1-7-19(20)24-22(26)28/h1-3,5-8,15,18H,4,9-14H2,(H,24,28) |
| InChIKey | GNWCYKNAKQLBCP-UHFFFAOYSA-N |
| Molecular Weight | 381.451 g/mol |
| SMILES | C1=2N(C(NC2C=CC=C1)=O)C1CCN(CC1)CCCC(C1=CC(=CC=C1)F)=O |