SpectraBase Spectrum ID |
HL9rwkiaztN |
Name |
Propanamide, 3-cyclopentyl-N-isobutyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
197.177964364 u |
Formula |
C12H23NO |
InChI |
InChI=1S/C12H23NO/c1-10(2)9-13-12(14)8-7-11-5-3-4-6-11/h10-11H,3-9H2,1-2H3,(H,13,14) |
InChIKey |
KSZTXWMYMBKTEP-UHFFFAOYSA-N |
Molecular Weight |
197.322 g/mol |
SMILES |
C(NCC(C)C)(=O)CCC1CCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.909966 |