| SpectraBase Compound ID | CNTIaguEwSj |
|---|---|
| InChI | InChI=1S/C7H12O4/c1-4(6(8)9)3-5(2)7(10)11/h4-5H,3H2,1-2H3,(H,8,9)(H,10,11) |
| InChIKey | VIWYMIDWAOZEAZ-UHFFFAOYSA-N |
| Mol Weight | 160.17 g/mol |
| Molecular Formula | C7H12O4 |
| Exact Mass | 160.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3oY0e8HD1pI |
|---|---|
| Name | 2,4-Dimethyl-pentanedioic acid |
| CAS Registry Number | 2121-67-7 |
| Comments | DIASTEREOMER B (80%) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H12O4 |
| InChI | InChI=1S/C7H12O4/c1-4(6(8)9)3-5(2)7(10)11/h4-5H,3H2,1-2H3,(H,8,9)(H,10,11) |
| InChIKey | VIWYMIDWAOZEAZ-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3/DMSO-D6 |