| SpectraBase Compound ID | 2yTSWRY8ROQ |
|---|---|
| InChI | InChI=1S/C16H20N2O4/c1-16(2,3)22-15(20)18-13(14(19)21-4)11-9-17-12-8-6-5-7-10(11)12/h5-9,13,17H,1-4H3,(H,18,20) |
| InChIKey | QDNIGAXSUFAMQD-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 | IfQ7uriMGsJ |
|---|---|
| Name | Methyl N-boc-indol-3-ylglycinate |
| 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/c1-16(2,3)22-15(20)18-13(14(19)21-4)11-9-17-12-8-6-5-7-10(11)12/h5-9,13,17H,1-4H3,(H,18,20) |
| InChIKey | QDNIGAXSUFAMQD-UHFFFAOYSA-N |
| Molecular Weight | 304.346 g/mol |
| SMILES | C1(=CNC2=C1C=CC=C2)C(NC(OC(C)(C)C)=O)C(=O)OC |