SpectraBase Compound ID | qHmC4iFBji |
---|---|
InChI | InChI=1S/C15H19NO4/c1-3-4-10-12(17)13(15(19)20-2)16-14(18)11-8-6-5-7-9-11/h5-9,13H,3-4,10H2,1-2H3,(H,16,18) |
InChIKey | FWWSVAHGUPLMDK-UHFFFAOYSA-N |
Mol Weight | 277.32 g/mol |
Molecular Formula | C15H19NO4 |
Exact Mass | 277.131408 g/mol |
SpectraBase Spectrum ID | DjOtYLVE8xF |
---|---|
Name | 2-Benzamido-3-keto-enanthic acid methyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 277.131408092 u |
Formula | C15H19NO4 |
InChI | InChI=1S/C15H19NO4/c1-3-4-10-12(17)13(15(19)20-2)16-14(18)11-8-6-5-7-9-11/h5-9,13H,3-4,10H2,1-2H3,(H,16,18) |
InChIKey | FWWSVAHGUPLMDK-UHFFFAOYSA-N |
SMILES | C(NC(=O)C1=CC=CC=C1)(C(=O)OC)C(=O)CCCC |