SpectraBase Spectrum ID |
7e1lghW7LGw |
Name |
Phenol, 5-amino-2-methoxy-, N,o-bis(N-propyloxycarbonyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
311.136887394 u |
Formula |
C15H21NO6 |
InChI |
InChI=1S/C15H21NO6/c1-4-8-20-14(17)16-11-6-7-12(19-3)13(10-11)22-15(18)21-9-5-2/h6-7,10H,4-5,8-9H2,1-3H3,(H,16,17) |
InChIKey |
LZKUOADUSLWBLB-UHFFFAOYSA-N |
Molecular Weight |
311.334 g/mol |
SMILES |
C1(=CC(NC(OCCC)=O)=CC=C1OC)OC(OCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.834478 |