SpectraBase Spectrum ID |
4GHE03bNGs9 |
Name |
N'-(6-Bromanyl-5-methyl-2-oxidanylidene-indol-3-yl)-2-[(2-methoxyphenyl)amino]ethanehydrazide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
416.048403420 u |
Formula |
C18H17BrN4O3 |
InChI |
InChI=1S/C18H17BrN4O3/c1-10-7-11-14(8-12(10)19)21-18(25)17(11)23-22-16(24)9-20-13-5-3-4-6-15(13)26-2/h3-8,20H,9H2,1-2H3,(H,22,24)(H,21,23,25) |
InChIKey |
RNBIMKTVOVMGSC-UHFFFAOYSA-N |
Molecular Weight |
417.263 g/mol |
SMILES |
C(C(N\N=C\1C(NC=2C=C(C(=CC12)C)Br)=O)=O)NC1=C(C=CC=C1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91714 |