| SpectraBase Compound ID | CIL2AZxkYSw |
|---|---|
| InChI | InChI=1S/C17H17NO5/c1-20-13-8-9-14-15(10-13)23-17(16(19)18(14)21-2)22-11-12-6-4-3-5-7-12/h3-10,17H,11H2,1-2H3 |
| InChIKey | ADONGNJKANERML-UHFFFAOYSA-N |
| Mol Weight | 315.33 g/mol |
| Molecular Formula | C17H17NO5 |
| Exact Mass | 315.110673 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | OZE0qndn7h |
|---|---|
| Name | 2-Benzyloxy-4,7-dimethoxy-2H-1,4-benzoxazin-3(4H)-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.110672646 u |
| Formula | C17H17NO5 |
| InChI | InChI=1S/C17H17NO5/c1-20-13-8-9-14-15(10-13)23-17(16(19)18(14)21-2)22-11-12-6-4-3-5-7-12/h3-10,17H,11H2,1-2H3 |
| InChIKey | ADONGNJKANERML-UHFFFAOYSA-N |
| Molecular Weight | 315.325 g/mol |
| SMILES | C1(N(C2=CC=C(C=C2OC1OCC=1C=CC=CC1)OC)OC)=O |