| SpectraBase Compound ID | 1gQyj9pYvoN |
|---|---|
| InChI | InChI=1S/C8H9NO3/c1-6-4-3-5-7(12-2)8(6)9(10)11/h3-5H,1-2H3/i1D3 |
| InChIKey | MGBRGNWARSQECY-FIBGUPNXSA-N |
| Mol Weight | 170.18 g/mol |
| Molecular Formula | C8H6D3NO3 |
| Exact Mass | 170.077073 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GzMuJRyjOve |
|---|---|
| Name | D3-1-Methoxy-3-methyl-2-nitrobenzene |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H6D3NO3 |
| InChI | InChI=1S/C8H9NO3/c1-6-4-3-5-7(12-2)8(6)9(10)11/h3-5H,1-2H3/i1D3 |
| InChIKey | MGBRGNWARSQECY-FIBGUPNXSA-N |
| Molecular Weight | 170.182 g/mol |
| SMILES | c1(N(=O)=O)c(OC)cccc1C([D])([D])[D] |
| SPLASH | splash10-00di-0900000000-f7ada07676a04f5f7cdc |
| Source of Spectrum | U1-2011-300-10 |
| Wiley ID | 1664880 |