| SpectraBase Compound ID | I2FSvHw0s1M |
|---|---|
| InChI | InChI=1S/C14H11NO4/c16-14(12-6-2-1-3-7-12)19-10-11-5-4-8-13(9-11)15(17)18/h1-9H,10H2 |
| InChIKey | XYHCAQKUZAEVJN-UHFFFAOYSA-N |
| Mol Weight | 257.24 g/mol |
| Molecular Formula | C14H11NO4 |
| Exact Mass | 257.068808 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Ipnw0OqMamR |
|---|---|
| Name | 3-Nitrobenzyl benzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H11NO4 |
| InChI | InChI=1S/C14H11NO4/c16-14(12-6-2-1-3-7-12)19-10-11-5-4-8-13(9-11)15(17)18/h1-9H,10H2 |
| InChIKey | XYHCAQKUZAEVJN-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 257.245 g/mol |
| SMILES | c1([N+]([O-])=O)cccc(c1)COC(=O)c1ccccc1 |
| SPLASH | splash10-0a4r-7900000000-8b71b2adb94cb6636c6b |
| Source of Spectrum | SRH-2022-11134-0 |
| Wiley ID | 1832739 |