| SpectraBase Spectrum ID |
CCu82u9DgrM |
| Name |
2-keto-1-(1-phenylethyl)nicotinic acid |
| Alternate Name(s) |
2-oxidanylidene-1-(1-phenylethyl)pyridine-3-carboxylic acid
2-oxo-1-(1-phenylethyl)-3-pyridinecarboxylic acid
2-oxo-1-(1-phenylethyl)pyridine-3-carboxylic acid |
| CAS Registry Number |
66158-21-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H13NO3 |
| InChI |
InChI=1S/C14H13NO3/c1-10(11-6-3-2-4-7-11)15-9-5-8-12(13(15)16)14(17)18/h2-10H,1H3,(H,17,18) |
| InChIKey |
KHIJAVHPLSAGLB-UHFFFAOYSA-N |
| Molecular Weight |
243.262 g/mol |
| SMILES |
OC(C=1C(N(C(c2ccccc2)C)C=CC1)=O)=O |
| SPLASH |
splash10-0a4i-0920000000-b09f51f588dcabeb8980 |
| Source of Spectrum |
Y-21-46-6 |
| Wiley ID |
1246073 |
