![2-[(4-Phenylbenzyl)amino]acetic acid methyl ester](/api/spectrum/LUirzox2fPb/structure.png?h=300&w=458 "2-[(4-Phenylbenzyl)amino]acetic acid methyl ester")
| SpectraBase Compound ID | 30BaVL0Legw |
|---|---|
| InChI | InChI=1S/C16H17NO2/c1-19-16(18)12-17-11-13-7-9-15(10-8-13)14-5-3-2-4-6-14/h2-10,17H,11-12H2,1H3 |
| InChIKey | KUNVANAOQDDKFJ-UHFFFAOYSA-N |
| Mol Weight | 255.32 g/mol |
| Molecular Formula | C16H17NO2 |
| Exact Mass | 255.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LUirzox2fPb |
|---|---|
| Name | 2-[(4-Phenylbenzyl)amino]acetic acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.125928789 u |
| Formula | C16H17NO2 |
| InChI | InChI=1S/C16H17NO2/c1-19-16(18)12-17-11-13-7-9-15(10-8-13)14-5-3-2-4-6-14/h2-10,17H,11-12H2,1H3 |
| InChIKey | KUNVANAOQDDKFJ-UHFFFAOYSA-N |
| Molecular Weight | 255.317 g/mol |
| SMILES | C(=O)(OC)CNCC1=CC=C(C=C1)C=1C=CC=CC1 |