| SpectraBase Compound ID | G1tVJsyGJQp |
|---|---|
| InChI | InChI=1S/C18H17ClN2O2/c1-3-23-17-18(22)21(2)15-10-9-13(19)11-14(15)16(20-17)12-7-5-4-6-8-12/h4-11,17H,3H2,1-2H3 |
| InChIKey | VKOWCMGAZOCOBF-UHFFFAOYSA-N |
| Mol Weight | 328.8 g/mol |
| Molecular Formula | C18H17ClN2O2 |
| Exact Mass | 328.097855 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6lX3Kr2HHn |
|---|---|
| Name | 3-Ethoxydiazepam |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.097855493 u |
| Formula | C18H17ClN2O2 |
| InChI | InChI=1S/C18H17ClN2O2/c1-3-23-17-18(22)21(2)15-10-9-13(19)11-14(15)16(20-17)12-7-5-4-6-8-12/h4-11,17H,3H2,1-2H3 |
| InChIKey | VKOWCMGAZOCOBF-UHFFFAOYSA-N |
| Molecular Weight | 328.799 g/mol |
| SMILES | C12=C(N(C(C(N=C2C2=CC=CC=C2)OCC)=O)C)C=CC(=C1)Cl |