SpectraBase Spectrum ID |
8TPTQlTRBIW |
Name |
1-Acetyl-3-(1,3-diacetylbenzimidazolin-2-yl)-2-oxindole |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
377.137556100 u |
Formula |
C21H19N3O4 |
InChI |
InChI=1S/C21H19N3O4/c1-12(25)22-17-10-6-7-11-18(17)23(13(2)26)20(22)19-15-8-4-5-9-16(15)24(14(3)27)21(19)28/h4-11,19-20H,1-3H3 |
InChIKey |
BPMHPAXYNJMSED-UHFFFAOYSA-N |
Molecular Weight |
377.400 g/mol |
SMILES |
C1(N(C2=C(N1C(=O)C)C=CC=C2)C(=O)C)C1C(N(C(=O)C)C=2C1=CC=CC2)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.850143 |