| SpectraBase Compound ID | HVcyVYA6fpE |
|---|---|
| InChI | InChI=1S/C12H12N2O3/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16/h3-7H,2H2,1H3,(H2,13,14,15,16,17) |
| InChIKey | DDBREPKUVSBGFI-UHFFFAOYSA-N |
| Mol Weight | 232.24 g/mol |
| Molecular Formula | C12H12N2O3 |
| Exact Mass | 232.084792 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | F0abIPl5JM6 |
|---|---|
| Name | Phenobarbital |
| Catalog Number | 9001494 |
| CAS Registry Number | 50-06-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12N2O3 |
| InChI | InChI=1S/C12H12N2O3/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16/h3-7H,2H2,1H3,(H2,13,14,15,16,17) |
| InChIKey | DDBREPKUVSBGFI-UHFFFAOYSA-N |
| Molecular Weight | 232.239 g/mol |
| SMILES | N1C(NC(C(C1=O)(c1ccccc1)CC)=O)=O |
| SPLASH | splash10-0uxr-5950000000-4244883426a7e8a788a2 |
| Source of Spectrum | CAY-2023-858-0 |
| Wiley ID | 1888816 |