| SpectraBase Spectrum ID |
6xsJ9m0yxXh |
| Name |
1-cyclopropyl-4-keto-nicotinic acid |
| Alternate Name(s) |
1-cyclopropyl-4-oxidanylidene-pyridine-3-carboxylic acid
1-cyclopropyl-4-oxo-3-pyridinecarboxylic acid
1-cyclopropyl-4-oxo-pyridine-3-carboxylic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H9NO3 |
| InChI |
InChI=1S/C9H9NO3/c11-8-3-4-10(6-1-2-6)5-7(8)9(12)13/h3-6H,1-2H2,(H,12,13) |
| InChIKey |
QLUOAKZZERAOTJ-UHFFFAOYSA-N |
| Molecular Weight |
179.175 g/mol |
| SMILES |
OC(C1=CN(C2CC2)C=CC1=O)=O |
| SPLASH |
splash10-000i-0900000000-a46e19048a4aee3d6795 |
| Source of Spectrum |
H1-50-873-4 |
| Wiley ID |
816880 |
