| SpectraBase Compound ID | 5EqQDeE3wdW |
|---|---|
| InChI | InChI=1S/C12H13NO4/c1-2-5-13-10(14)8-4-3-7(12(16)17)6-9(8)11(13)15/h3-4,6,10,14H,2,5H2,1H3,(H,16,17) |
| InChIKey | YKNNCNNULDQHDW-UHFFFAOYSA-N |
| Mol Weight | 235.24 g/mol |
| Molecular Formula | C12H13NO4 |
| Exact Mass | 235.084458 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | Kp1QJYz4z8y |
|---|---|
| Name | 1-hydroxy-3-oxo-2-propyl-5-isoindolinecarboxylic acid |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.084457899 u |
| Formula | C12H13NO4 |
| InChI | InChI=1S/C12H13NO4/c1-2-5-13-10(14)8-4-3-7(12(16)17)6-9(8)11(13)15/h3-4,6,10,14H,2,5H2,1H3,(H,16,17) |
| InChIKey | YKNNCNNULDQHDW-UHFFFAOYSA-N |
| Molecular Weight | 235.239 g/mol |
| NMR Offset | 18.0059 |
| NMR Spectrometer Frequency | 300.135 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_8927 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12669553 |
| Temperature | 23.85 °C |