| SpectraBase Compound ID | BgF9ACu67KU |
|---|---|
| InChI | InChI=1S/C6H12N2O5/c1-3-6(9,4-7(10)11)5(2)8(12)13/h5,9H,3-4H2,1-2H3 |
| InChIKey | PHQAFUDMLXMVMD-UHFFFAOYSA-N |
| Mol Weight | 192.17 g/mol |
| Molecular Formula | C6H12N2O5 |
| Exact Mass | 192.074621 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JU9vxtpZErI |
|---|---|
| Name | 2-ETHYL-2-HYDROXY-1,3-DINITRO-BUTANE;ISOMER-A |
| Compound Number | 13 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C6H12N2O5/c1-3-6(9,4-7(10)11)5(2)8(12)13/h5,9H,3-4H2,1-2H3 |
| InChIKey | PHQAFUDMLXMVMD-UHFFFAOYSA-N |
| Literature Reference | P.GOLDING,J.L.POWELL,J.H.RIDD J.CHEM.SOC.PERKIN-2,813(1996) |
| Solvent | Chloroform |