SpectraBase Compound ID | FJA0JWafwZg |
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InChI | InChI=1S/C16H18N2O3/c19-15(18-7-5-11(6-8-18)16(20)21)9-12-10-17-14-4-2-1-3-13(12)14/h1-4,10-11,17H,5-9H2,(H,20,21) |
InChIKey | UDHFALXPDYJIJO-UHFFFAOYSA-N |
Mol Weight | 286.33 g/mol |
Molecular Formula | C16H18N2O3 |
Exact Mass | 286.131742 g/mol |
SpectraBase Spectrum ID | CiCHOEftXMC |
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Name | 1-(1H-Indol-3-ylacetyl)-4-piperidinecarboxylic acid |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 286.131742445 u |
Formula | C16H18N2O3 |
InChI | InChI=1S/C16H18N2O3/c19-15(18-7-5-11(6-8-18)16(20)21)9-12-10-17-14-4-2-1-3-13(12)14/h1-4,10-11,17H,5-9H2,(H,20,21) |
InChIKey | UDHFALXPDYJIJO-UHFFFAOYSA-N |
Molecular Weight | 286.331 g/mol |
SMILES | N1C2=C(C(CC(N3CCC(C(=O)O)CC3)=O)=C1)C=CC=C2 |