| SpectraBase Spectrum ID |
80bqXMvP6QF |
| Name |
Benzo[1,3]dioxole-5-carboxylic acid (5-chloro-2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
343.035983510 u |
| Formula |
C16H10ClN3O4 |
| InChI |
InChI=1S/C16H10ClN3O4/c17-9-2-3-11-10(6-9)14(16(22)18-11)19-20-15(21)8-1-4-12-13(5-8)24-7-23-12/h1-6H,7H2,(H,20,21)(H,18,19,22) |
| InChIKey |
JTYYFVKWGVDSHG-UHFFFAOYSA-N |
| Molecular Weight |
343.726 g/mol |
| SMILES |
C1(\C(C2=C(N1)C=CC(=C2)Cl)=N\NC(C=1C=C2C(=CC1)OCO2)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96843 |
![Benzo[1,3]dioxole-5-carboxylic acid (5-chloro-2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazide](/api/spectrum/80bqXMvP6QF/structure.png?h=300&w=458 "Benzo[1,3]dioxole-5-carboxylic acid (5-chloro-2-oxo-1,2-dihydro-indol-3-ylidene)-hydrazide")
