| SpectraBase Compound ID | 8JJ851CTiuN |
|---|---|
| InChI | InChI=1S/C8H14O4/c1-3-4-5-6(7(9)10)8(11)12-2/h6H,3-5H2,1-2H3,(H,9,10) |
| InChIKey | GIQUGXMHRJYRKI-UHFFFAOYSA-N |
| Mol Weight | 174.2 g/mol |
| Molecular Formula | C8H14O4 |
| Exact Mass | 174.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1qqzhul0MmM |
|---|---|
| Name | N-Butyl-malonic-acid, mono-methylester |
| CAS Registry Number | 73891-59-5 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C8H14O4 |
| InChI | InChI=1S/C8H14O4/c1-3-4-5-6(7(9)10)8(11)12-2/h6H,3-5H2,1-2H3,(H,9,10) |
| InChIKey | GIQUGXMHRJYRKI-UHFFFAOYSA-N |
| Instrument Name | SF = 100 MHz |
| Literature Reference | J. Org. Chem. 45, 3268 (1980). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |