SpectraBase Compound ID | 3Nm50Fwuc1u |
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InChI | InChI=1S/C17H15NO4/c1-22-17(21)15(11-12-7-9-14(19)10-8-12)18-16(20)13-5-3-2-4-6-13/h2-11,19H,1H3,(H,18,20)/b15-11- |
InChIKey | BWDBYWRHPHUIHA-PTNGSMBKSA-N |
Mol Weight | 297.31 g/mol |
Molecular Formula | C17H15NO4 |
Exact Mass | 297.100108 g/mol |
SpectraBase Spectrum ID | IE0DXOWdj3S |
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Name | Cinnamic acid, .alpha.-[N-benzoylamino]-4-hydroxy-, methyl(ester) |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 297.100107963 u |
Formula | C17H15NO4 |
InChI | InChI=1S/C17H15NO4/c1-22-17(21)15(11-12-7-9-14(19)10-8-12)18-16(20)13-5-3-2-4-6-13/h2-11,19H,1H3,(H,18,20)/b15-11- |
InChIKey | BWDBYWRHPHUIHA-PTNGSMBKSA-N |
SMILES | C1=CC(=CC=C1O)\C=C\(C(OC)=O)NC(=O)C1=CC=CC=C1 |