| SpectraBase Compound ID | J9pvr65AGbt |
|---|---|
| InChI | InChI=1S/C16H20N2O4/c1-3-8-22-16(20)18-14(15(19)21-2)9-11-10-17-13-7-5-4-6-12(11)13/h4-7,10,14,17H,3,8-9H2,1-2H3,(H,18,20) |
| InChIKey | UKVIQISOCDSRRP-UHFFFAOYSA-N |
| Mol Weight | 304.35 g/mol |
| Molecular Formula | C16H20N2O4 |
| Exact Mass | 304.142307 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EM0RmWz7nDg |
|---|---|
| Name | L-Tryptophan, N-(N-propyloxycarbonyl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.142307128 u |
| Formula | C16H20N2O4 |
| InChI | InChI=1S/C16H20N2O4/c1-3-8-22-16(20)18-14(15(19)21-2)9-11-10-17-13-7-5-4-6-12(11)13/h4-7,10,14,17H,3,8-9H2,1-2H3,(H,18,20) |
| InChIKey | UKVIQISOCDSRRP-UHFFFAOYSA-N |
| Molecular Weight | 304.346 g/mol |
| SMILES | C1=CC=CC2=C1C(=CN2)CC(NC(OCCC)=O)C(OC)=O |