| SpectraBase Compound ID | 2PQP7K2qJlr |
|---|---|
| InChI | InChI=1S/C12H14N2O3/c1-7(15)2-5-11-13-9-4-3-8(12(16)17)6-10(9)14-11/h3-4,6-7,15H,2,5H2,1H3,(H,13,14)(H,16,17) |
| InChIKey | NUEQRBGDMHCABN-UHFFFAOYSA-N |
| Mol Weight | 234.25 g/mol |
| Molecular Formula | C12H14N2O3 |
| Exact Mass | 234.100442 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | Tc0cTlFQr4 |
|---|---|
| Name | 2-(3-hydroxybutyl)-1H-benzimidazole-5-carboxylic 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 | 234.100442316 u |
| Formula | C12H14N2O3 |
| InChI | InChI=1S/C12H14N2O3/c1-7(15)2-5-11-13-9-4-3-8(12(16)17)6-10(9)14-11/h3-4,6-7,15H,2,5H2,1H3,(H,13,14)(H,16,17) |
| InChIKey | NUEQRBGDMHCABN-UHFFFAOYSA-N |
| Molecular Weight | 234.255 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_5823 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12318849 |