| SpectraBase Compound ID | JEIXhYyvRNu |
|---|---|
| InChI | InChI=1S/C7H5NO3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-5H |
| InChIKey | BXRFQSNOROATLV-UHFFFAOYSA-N |
| Mol Weight | 151.12 g/mol |
| Molecular Formula | C7H5NO3 |
| Exact Mass | 151.026943 g/mol |
17O Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7GF4ZiaDogC |
|---|---|
| Name | 4-Nitrobenzaldehyde |
| CAS Registry Number | 555-16-8 |
| Comments | enrichment/labelling |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C7H5NO3 |
| InChI | InChI=1S/C7H5NO3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-5H |
| InChIKey | BXRFQSNOROATLV-UHFFFAOYSA-N |
| Literature Reference | J. Am. Chem. Soc. 103, 1128 (1981). |
| NMR Standard | not reported |
| Observed nucleus | 17O |
| Solvent | Dioxane |