| SpectraBase Compound ID | IwGjw2BWH5a |
|---|---|
| InChI | InChI=1S/C7H15NO4/c1-4(2)7(10)6(5(3)9)8(11)12/h4-7,9-10H,1-3H3 |
| InChIKey | MHMKYCQSVYJNNY-UHFFFAOYSA-N |
| Mol Weight | 177.2 g/mol |
| Molecular Formula | C7H15NO4 |
| Exact Mass | 177.100108 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2I2pCi1yvEb |
|---|---|
| Name | 5-Methyl-3-nitro-2,4-hexanediol |
| CAS Registry Number | 96094-32-5 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H15NO4 |
| InChI | InChI=1S/C7H15NO4/c1-4(2)7(10)6(5(3)9)8(11)12/h4-7,9-10H,1-3H3 |
| InChIKey | MHMKYCQSVYJNNY-UHFFFAOYSA-N |
| Literature Reference | M. Eyer, D. Seebach, J. Am. Chem. Soc. 107, 3601 (1985). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Acetone-D6 |