SpectraBase Spectrum ID |
A0phJ5h3VTI |
Name |
Cyclopropanecarboxamide, N-(2-methyl-2-heptyl) |
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/c1-4-5-6-9-12(2,3)13-11(14)10-7-8-10/h10H,4-9H2,1-3H3,(H,13,14) |
InChIKey |
WJXIQCSHPBLQQK-UHFFFAOYSA-N |
Molecular Weight |
197.322 g/mol |
SMILES |
C1CC1C(=O)NC(C)(C)CCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963141 |