SpectraBase Spectrum ID |
HbD2cagxCeH |
Name |
3-(6-Bromopiperonylidene)-2-indolinone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
342.984406183 u |
Formula |
C16H10BrNO3 |
InChI |
InChI=1S/C16H10BrNO3/c17-12-7-15-14(20-8-21-15)6-9(12)5-11-10-3-1-2-4-13(10)18-16(11)19/h1-7H,8H2,(H,18,19) |
InChIKey |
KTNJQKPPIYOCPU-UHFFFAOYSA-N |
Molecular Weight |
344.164 g/mol |
SMILES |
N1C=2C=CC=CC2C(C1=O)=CC=1C=C2OCOC2=CC1Br |
Spectrum/Structure Validation Score (Raman) |
0.943683 |