SpectraBase Spectrum ID |
16hbBhJMMno |
Name |
2-Isopropyl-N-methylaniline, 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/c1-5-10-17-14(16)15(4)13-9-7-6-8-12(13)11(2)3/h6-9,11H,5,10H2,1-4H3 |
InChIKey |
FWSMRWFRPUPOHN-UHFFFAOYSA-N |
Molecular Weight |
235.327 g/mol |
SMILES |
CN(C1=C(C(C)C)C=CC=C1)C(OCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.888683 |