![1-Benzyl-1-aza-2-oxo-3-methoxy-benzo[6,7-a]cycloheptane](/api/spectrum/7PoYWden1K0/structure.png?h=300&w=458 "1-Benzyl-1-aza-2-oxo-3-methoxy-benzo[6,7-a]cycloheptane")
| SpectraBase Compound ID | 6725XITfzkF |
|---|---|
| InChI | InChI=1S/C18H19NO2/c1-21-17-12-11-15-9-5-6-10-16(15)19(18(17)20)13-14-7-3-2-4-8-14/h2-10,17H,11-13H2,1H3 |
| InChIKey | HUPQMOUDIXHMMG-UHFFFAOYSA-N |
| Mol Weight | 281.36 g/mol |
| Molecular Formula | C18H19NO2 |
| Exact Mass | 281.141579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7PoYWden1K0 |
|---|---|
| Name | 1-Benzyl-1-aza-2-oxo-3-methoxy-benzo[6,7-A]cycloheptane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.141578854 u |
| Formula | C18H19NO2 |
| InChI | InChI=1S/C18H19NO2/c1-21-17-12-11-15-9-5-6-10-16(15)19(18(17)20)13-14-7-3-2-4-8-14/h2-10,17H,11-13H2,1H3 |
| InChIKey | HUPQMOUDIXHMMG-UHFFFAOYSA-N |
| SMILES | C1(N(C=2C(CCC1OC)=CC=CC2)CC=1C=CC=CC1)=O |