SpectraBase Spectrum ID |
KbXtSs4xsFO |
Name |
4-Tert-butylaniline, N-(N-propyloxycarbonyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
235.157228918 u |
Formula |
C14H21NO2 |
InChI |
InChI=1S/C14H21NO2/c1-5-10-17-13(16)15-12-8-6-11(7-9-12)14(2,3)4/h6-9H,5,10H2,1-4H3,(H,15,16) |
InChIKey |
DGZJGEYOHZBCSM-UHFFFAOYSA-N |
Molecular Weight |
235.327 g/mol |
SMILES |
C(C)(C)(C)C1=CC=C(C=C1)NC(OCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955359 |