| SpectraBase Spectrum ID |
IkipKBkFtJv |
| Name |
N-Acetyl-4-(4-fluorophenyl)-3-morpholinopyrrol-2-carboxylic acid, methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.132885259 u |
| Formula |
C18H19FN2O4 |
| InChI |
InChI=1S/C18H19FN2O4/c1-12(22)21-11-15(13-3-5-14(19)6-4-13)16(17(21)18(23)24-2)20-7-9-25-10-8-20/h3-6,11H,7-10H2,1-2H3 |
| InChIKey |
MDMPIWRFGDCDSO-UHFFFAOYSA-N |
| Molecular Weight |
346.358 g/mol |
| SMILES |
C=1N(C(C(OC)=O)=C(C1C1=CC=C(C=C1)F)N1CCOCC1)C(C)=O |
