SpectraBase Compound ID | 6L8Nft3NNH0 |
---|---|
InChI | InChI=1S/C20H15NO5/c22-20(16-7-4-8-17(13-16)21(23)24)26-19-11-9-18(10-12-19)25-14-15-5-2-1-3-6-15/h1-13H,14H2 |
InChIKey | QNVNLGXNNORDDN-UHFFFAOYSA-N |
Mol Weight | 349.34 g/mol |
Molecular Formula | C20H15NO5 |
Exact Mass | 349.095023 g/mol |
SpectraBase Spectrum ID | 3zBbht5tU8C |
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Name | 3-Nitro-benzoic acid 4-benzyloxy-phenyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 349.095022582 u |
Formula | C20H15NO5 |
InChI | InChI=1S/C20H15NO5/c22-20(16-7-4-8-17(13-16)21(23)24)26-19-11-9-18(10-12-19)25-14-15-5-2-1-3-6-15/h1-13H,14H2 |
InChIKey | QNVNLGXNNORDDN-UHFFFAOYSA-N |
Molecular Weight | 349.342 g/mol |
SMILES | C1(=CC(=CC=C1)N(=O)=O)C(OC1=CC=C(C=C1)OCC1=CC=CC=C1)=O |