SpectraBase Spectrum ID |
BIsBJv5E5V4 |
Name |
Cyclobutanecarboxamide, N-benzyl-N-isobutyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
245.177964364 u |
Formula |
C16H23NO |
InChI |
InChI=1S/C16H23NO/c1-13(2)11-17(16(18)15-9-6-10-15)12-14-7-4-3-5-8-14/h3-5,7-8,13,15H,6,9-12H2,1-2H3 |
InChIKey |
LZVHFAVUMCKNMX-UHFFFAOYSA-N |
Molecular Weight |
245.366 g/mol |
SMILES |
C(N(CC1=CC=CC=C1)CC(C)C)(=O)C1CCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.848227 |