![dl-2-[(Benzylamino)methyl]succinanilic acid](/api/spectrum/HtT5gqwZ5Lq/structure.png?h=300&w=458 "dl-2-[(Benzylamino)methyl]succinanilic acid")
| SpectraBase Compound ID | 9ojFA6Amtml |
|---|---|
| InChI | InChI=1S/C18H20N2O3/c21-17(20-16-9-5-2-6-10-16)11-15(18(22)23)13-19-12-14-7-3-1-4-8-14/h1-10,15,19H,11-13H2,(H,20,21)(H,22,23) |
| InChIKey | VCIUAGPQTPYECB-UHFFFAOYSA-N |
| Mol Weight | 312.37 g/mol |
| Molecular Formula | C18H20N2O3 |
| Exact Mass | 312.147393 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HtT5gqwZ5Lq |
|---|---|
| Name | dl-2-[(Benzylamino)methyl]succinanilic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.147392509 u |
| Formula | C18H20N2O3 |
| InChI | InChI=1S/C18H20N2O3/c21-17(20-16-9-5-2-6-10-16)11-15(18(22)23)13-19-12-14-7-3-1-4-8-14/h1-10,15,19H,11-13H2,(H,20,21)(H,22,23) |
| InChIKey | VCIUAGPQTPYECB-UHFFFAOYSA-N |
| SMILES | N(C=1C=CC=CC1)C(CC(CNCC=1C=CC=CC1)C(O)=O)=O |