![1-(ethoxymethyl)benzo[cd]indol-2(1H)-one](/api/spectrum/Du2IoW5gSiu/structure.png?h=300&w=458 "1-(ethoxymethyl)benzo[cd]indol-2(1H)-one")
| SpectraBase Compound ID | 2fAxRqLXV6V |
|---|---|
| InChI | InChI=1S/C14H13NO2/c1-2-17-9-15-12-8-4-6-10-5-3-7-11(13(10)12)14(15)16/h3-8H,2,9H2,1H3 |
| InChIKey | NDCSYAWFNJMLRY-UHFFFAOYSA-N |
| Mol Weight | 227.26 g/mol |
| Molecular Formula | C14H13NO2 |
| Exact Mass | 227.094629 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Du2IoW5gSiu |
|---|---|
| Name | 1-(Ethoxymethyl)benzo[cd]indol-2(1H)-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.094628661 u |
| Formula | C14H13NO2 |
| InChI | InChI=1S/C14H13NO2/c1-2-17-9-15-12-8-4-6-10-5-3-7-11(13(10)12)14(15)16/h3-8H,2,9H2,1H3 |
| InChIKey | NDCSYAWFNJMLRY-UHFFFAOYSA-N |
| Molecular Weight | 227.263 g/mol |
| SMILES | C1(N(C2=C3C(C=CC=C13)=CC=C2)COCC)=O |