SpectraBase Spectrum ID |
KbL0CdNKiu7 |
Name |
Cyclohex-3-enecarboxylic acid, 6-[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 |
326.163042573 u |
Formula |
C19H22N2O3 |
InChI |
InChI=1S/C19H22N2O3/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/h2-6,9,15-16,21H,7-8,10-11H2,1H3,(H,20,22)(H,23,24) |
InChIKey |
BWNVJRYTHVWIGP-UHFFFAOYSA-N |
Molecular Weight |
326.396 g/mol |
SMILES |
C1(C(NCCC2=C(C)NC3=C2C=CC=C3)=O)C(C(=O)O)CC=CC1 |