| SpectraBase Compound ID | 1SzhnufWuWa |
|---|---|
| InChI | InChI=1S/C8H7NO3/c1-6-3-2-4-8(9(11)12)7(6)5-10/h2-5H,1H3 |
| InChIKey | LBHWNZFYCKTRFN-UHFFFAOYSA-N |
| Mol Weight | 165.15 g/mol |
| Molecular Formula | C8H7NO3 |
| Exact Mass | 165.042593 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 360np7Lx77D |
|---|---|
| Name | 2-Methyl-6-nitrobenzaldehyde |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7NO3 |
| InChI | InChI=1S/C8H7NO3/c1-6-3-2-4-8(9(11)12)7(6)5-10/h2-5H,1H3 |
| InChIKey | LBHWNZFYCKTRFN-UHFFFAOYSA-N |
| Molecular Weight | 165.148 g/mol |
| SMILES | C(c1c(cccc1[N+](=O)[O-])C)=O |
| SPLASH | splash10-000i-0900000000-346c7fd721da941dabfc |
| Source of Spectrum | U1-2014-5833-3b |
| Wiley ID | 1740864 |