SpectraBase Spectrum ID |
6VUaV8BGZKY |
Name |
o-Tolylamino-acetic acid [1-(2,5-dihydroxy-phenyl)-ethylidene]-hydrazide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
313.142641481 u |
Formula |
C17H19N3O3 |
InChI |
InChI=1S/C17H19N3O3/c1-11-5-3-4-6-15(11)18-10-17(23)20-19-12(2)14-9-13(21)7-8-16(14)22/h3-9,18,21-22H,10H2,1-2H3,(H,20,23)/b19-12+ |
InChIKey |
HZEFVNLIWCUEGV-XDHOZWIPSA-N |
Molecular Weight |
313.357 g/mol |
SMILES |
C1(\C(=N\NC(=O)CNC2=CC=CC=C2C)C)=C(C=CC(=C1)O)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.811723 |