SpectraBase Spectrum ID |
H0g7l3mpWnp |
Name |
2,5-di-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 |
291.219829176 u |
Formula |
C18H29NO2 |
InChI |
InChI=1S/C18H29NO2/c1-8-11-21-16(20)19-15-12-13(17(2,3)4)9-10-14(15)18(5,6)7/h9-10,12H,8,11H2,1-7H3,(H,19,20) |
InChIKey |
KJYSSWKFVLUFFA-UHFFFAOYSA-N |
SMILES |
C(C)(C)(C)C1=CC(NC(OCCC)=O)=C(C=C1)C(C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959093 |