| SpectraBase Compound ID | LYIE5AulKOK |
|---|---|
| InChI | InChI=1S/C8H12O6/c9-6(10)3-1-5(8(13)14)2-4-7(11)12/h5H,1-4H2,(H,9,10)(H,11,12)(H,13,14) |
| InChIKey | ROTJZTYLACIJIG-UHFFFAOYSA-N |
| Mol Weight | 204.18 g/mol |
| Molecular Formula | C8H12O6 |
| Exact Mass | 204.063388 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ErR370yWrPs |
|---|---|
| Name | 1,3,5-Pentanetricarboxylic acid |
| CAS Registry Number | 6940-58-5 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H12O6 |
| InChI | InChI=1S/C8H12O6/c9-6(10)3-1-5(8(13)14)2-4-7(11)12/h5H,1-4H2,(H,9,10)(H,11,12)(H,13,14) |
| InChIKey | ROTJZTYLACIJIG-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| NMR Standard | Dioxane |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |