| SpectraBase Spectrum ID |
GDsql7oi3jh |
| Name |
Crotonamide, N-(2-pentyl)-N-butyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
211.193614428 u |
| Formula |
C13H25NO |
| InChI |
InChI=1S/C13H25NO/c1-5-8-11-14(12(4)9-6-2)13(15)10-7-3/h7,10,12H,5-6,8-9,11H2,1-4H3/b10-7+ |
| InChIKey |
FLZJOMKOOUTENJ-JXMROGBWSA-N |
| Molecular Weight |
211.349 g/mol |
| SMILES |
CCCC(N(C(=O)\C=C\C)CCCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.845357 |
