SpectraBase Spectrum ID |
A3SZNqgQ4d0 |
Name |
1H-Indole-1-acetic acid, 3-[2-(4-ethylphenyl)-2-oxoethyl]-2,3-dihydro-3-hydroxy-2-oxo-, ethyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
381.157622840 u |
Formula |
C22H23NO5 |
InChI |
InChI=1S/C22H23NO5/c1-3-15-9-11-16(12-10-15)19(24)13-22(27)17-7-5-6-8-18(17)23(21(22)26)14-20(25)28-4-2/h5-12,27H,3-4,13-14H2,1-2H3 |
InChIKey |
HUDGGRLXPMQYLD-UHFFFAOYSA-N |
Molecular Weight |
381.428 g/mol |
SMILES |
OC1(C(N(C2=C1C=CC=C2)CC(=O)OCC)=O)CC(C1=CC=C(C=C1)CC)=O |