| SpectraBase Spectrum ID |
5NI2MmOZb0T |
| Name |
Imidazole |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
116421-26-2
146117-15-9
1467-16-9
288-32-4
5587-42-8 |
| ChEBI ID |
16069 |
| Comments |
100 mM imidazole - vendor: Sigma i5513; Solvent: D2O; Buffers, etc: 50 mM Sodium Phosphate, 500 uM NaAzide; Temperature=298 K, pH=7.4; NMR Reference: 500 uM DSS; Bruker DMX 400MHz
(Data collected by Madison Metabolomics Consortium) |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C3H4N2 |
| IUPAC Name |
1H-imidazole |
| InChI |
InChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5) |
| InChIKey |
RAXXELZNTBOGNW-UHFFFAOYSA-N |
| KEGG Compound ID |
C01589 |
| PubChem Compound ID |
795 |
| SMILES |
C1=CN=CN1 |
| Source File Reference |
bmse000096 |
