| SpectraBase Compound ID | IRx2VEzBkex |
|---|---|
| InChI | InChI=1S/C7H9NO4/c9-4-5-2-1-3-6(10)7(5)8(11)12/h1,3-7,10H,2H2/t5-,6+,7-/m0/s1 |
| InChIKey | WWYUCAGWTWSHCY-XVMARJQXSA-N |
| Mol Weight | 171.15 g/mol |
| Molecular Formula | C7H9NO4 |
| Exact Mass | 171.053158 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CbckiRUepFA |
|---|---|
| Name | (1S,5S,6R)-5-HYDROXY-6-NITROCYCLOHEX-3-ENE-1-CARBALDEHYDE |
| Compound Number | 7E |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C7H9NO4/c9-4-5-2-1-3-6(10)7(5)8(11)12/h1,3-7,10H,2H2/t5-,6+,7-/m0/s1 |
| InChIKey | WWYUCAGWTWSHCY-XVMARJQXSA-N |
| Literature Reference | J.A.SERRANO,L.E.CACERES,E.ROMAN J.CHEM.SOC.PERKIN-1,1863(1995) |
| Solvent | Chloroform-d |