![Methyl {[(5-chloro-1H-indol-2-yl)carbonyl]amino}acetate](/api/spectrum/5F8bfTmcxRv/structure.png?h=300&w=458 "Methyl {[(5-chloro-1H-indol-2-yl)carbonyl]amino}acetate")
| SpectraBase Compound ID | 3bFCNojNjqd |
|---|---|
| InChI | InChI=1S/C12H11ClN2O3/c1-18-11(16)6-14-12(17)10-5-7-4-8(13)2-3-9(7)15-10/h2-5,15H,6H2,1H3,(H,14,17) |
| InChIKey | BTPZWJDICBQQOS-UHFFFAOYSA-N |
| Mol Weight | 266.68 g/mol |
| Molecular Formula | C12H11ClN2O3 |
| Exact Mass | 266.04582 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5F8bfTmcxRv |
|---|---|
| Name | Methyl {[(5-chloro-1H-indol-2-yl)carbonyl]amino}acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.045819919 u |
| Formula | C12H11ClN2O3 |
| InChI | InChI=1S/C12H11ClN2O3/c1-18-11(16)6-14-12(17)10-5-7-4-8(13)2-3-9(7)15-10/h2-5,15H,6H2,1H3,(H,14,17) |
| InChIKey | BTPZWJDICBQQOS-UHFFFAOYSA-N |
| Molecular Weight | 266.684 g/mol |
| SMILES | C(NCC(OC)=O)(=O)C=1NC2=CC=C(C=C2C1)Cl |