| SpectraBase Spectrum ID |
31mKPYUlLhx |
| Name |
1-isopropyl-2-keto-nicotinic acid |
| Alternate Name(s) |
1-isopropyl-2-oxo-1,2-dihydro-3-pyridinecarboxylic acid
1-isopropyl-2-oxo-pyridine-3-carboxylic acid
2-oxidanylidene-1-propan-2-yl-pyridine-3-carboxylic acid
2-oxo-1-propan-2-yl-3-pyridinecarboxylic acid
2-oxo-1-propan-2-ylpyridine-3-carboxylic acid |
| CAS Registry Number |
66158-30-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H11NO3 |
| InChI |
InChI=1S/C9H11NO3/c1-6(2)10-5-3-4-7(8(10)11)9(12)13/h3-6H,1-2H3,(H,12,13) |
| InChIKey |
WMHUUEGGTAJRCB-UHFFFAOYSA-N |
| Molecular Weight |
181.191 g/mol |
| SMILES |
OC(C=1C(N(C=CC1)C(C)C)=O)=O |
| SPLASH |
splash10-0002-9200000000-a8ef7dd67d4e372c7451 |
| Source of Spectrum |
Y-21-46-6 |
| Wiley ID |
1177343 |
