![Cyclohexanecarboxylic acid, 2-[2-(2-methyl-1H-indol-3-yl)ethylcarbamoyl]-](/api/spectrum/9wCtNdn6sN5/structure.png?h=300&w=458 "Cyclohexanecarboxylic acid, 2-[2-(2-methyl-1H-indol-3-yl)ethylcarbamoyl]-")
| SpectraBase Compound ID | Kra1VOB8SDJ |
|---|---|
| InChI | InChI=1S/C19H24N2O3/c1-12-13(14-6-4-5-9-17(14)21-12)10-11-20-18(22)15-7-2-3-8-16(15)19(23)24/h4-6,9,15-16,21H,2-3,7-8,10-11H2,1H3,(H,20,22)(H,23,24) |
| InChIKey | SZGSYAYSLVXQCL-UHFFFAOYSA-N |
| Mol Weight | 328.41 g/mol |
| Molecular Formula | C19H24N2O3 |
| Exact Mass | 328.178693 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9wCtNdn6sN5 |
|---|---|
| Name | Cyclohexanecarboxylic acid, 2-[2-(2-methyl-1H-indol-3-yl)ethylcarbamoyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.178692638 u |
| Formula | C19H24N2O3 |
| InChI | InChI=1S/C19H24N2O3/c1-12-13(14-6-4-5-9-17(14)21-12)10-11-20-18(22)15-7-2-3-8-16(15)19(23)24/h4-6,9,15-16,21H,2-3,7-8,10-11H2,1H3,(H,20,22)(H,23,24) |
| InChIKey | SZGSYAYSLVXQCL-UHFFFAOYSA-N |
| Molecular Weight | 328.412 g/mol |
| SMILES | C(CC1=C(C)NC=2C1=CC=CC2)NC(=O)C1C(C(O)=O)CCCC1 |