| SpectraBase Spectrum ID |
K7uRXgBQJtK |
| Name |
2-Butenoic acid, 2-(acetylamino)-3-methyl-, 2-(4-bromophenyl)-2-oxoethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
353.026270995 u |
| Formula |
C15H16BrNO4 |
| InChI |
InChI=1S/C15H16BrNO4/c1-9(2)14(17-10(3)18)15(20)21-8-13(19)11-4-6-12(16)7-5-11/h4-7H,8H2,1-3H3,(H,17,18) |
| InChIKey |
IZVFJDJHMZQLNU-UHFFFAOYSA-N |
| Molecular Weight |
354.200 g/mol |
| SMILES |
C(NC(=C(C)C)C(OCC(=O)C1=CC=C(C=C1)Br)=O)(=O)C |
