| SpectraBase Compound ID | KtUoIGTrAMY |
|---|---|
| InChI | InChI=1S/C18H18N2O3/c19-16(18(21)22)8-13-10-20-17-9-14(6-7-15(13)17)23-11-12-4-2-1-3-5-12/h1-7,9-10,16,20H,8,11,19H2,(H,21,22) |
| InChIKey | CIIAXGODDHHBDG-UHFFFAOYSA-N |
| Mol Weight | 310.35 g/mol |
| Molecular Formula | C18H18N2O3 |
| Exact Mass | 310.131742 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7XhRag2VfmY |
|---|---|
| Name | dl-6-Benzyloxytryptophan |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.131742445 u |
| Formula | C18H18N2O3 |
| InChI | InChI=1S/C18H18N2O3/c19-16(18(21)22)8-13-10-20-17-9-14(6-7-15(13)17)23-11-12-4-2-1-3-5-12/h1-7,9-10,16,20H,8,11,19H2,(H,21,22) |
| InChIKey | CIIAXGODDHHBDG-UHFFFAOYSA-N |
| Molecular Weight | 310.353 g/mol |
| SMILES | C1=CC(=CC2=C1C(CC(C(O)=O)N)=CN2)OCC=1C=CC=CC1 |