| SpectraBase Compound ID | Ex6q2d87cIi |
|---|---|
| InChI | InChI=1S/C12H15NO4/c1-8(14)13-7-12(16)10-3-5-11(6-4-10)17-9(2)15/h3-6,12,16H,7H2,1-2H3,(H,13,14) |
| InChIKey | WKUKBMQCIDCIAI-UHFFFAOYSA-N |
| Mol Weight | 237.25 g/mol |
| Molecular Formula | C12H15NO4 |
| Exact Mass | 237.100108 g/mol |
| SpectraBase Spectrum ID | 5XSOGK6PTeU |
|---|---|
| Name | Acetamide, N-[2-[4-(acetyloxy)phenyl]-2-hydroxyethyl]-, (.+-.)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 237.100107963 u |
| Formula | C12H15NO4 |
| InChI | InChI=1S/C12H15NO4/c1-8(14)13-7-12(16)10-3-5-11(6-4-10)17-9(2)15/h3-6,12,16H,7H2,1-2H3,(H,13,14) |
| InChIKey | WKUKBMQCIDCIAI-UHFFFAOYSA-N |
| Molecular Weight | 237.255 g/mol |
| SMILES | C(NCC(C1=CC=C(OC(=O)C)C=C1)O)(=O)C |