| SpectraBase Spectrum ID |
6bn7ybZn2zF |
| Name |
1-Cyclohexyl-trans-3-dimethylamino-2-propen-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
181.146664235 u |
| Formula |
C11H19NO |
| InChI |
InChI=1S/C11H19NO/c1-12(2)9-8-11(13)10-6-4-3-5-7-10/h8-10H,3-7H2,1-2H3/b9-8+ |
| InChIKey |
PPDVDNFZPYRBJB-CMDGGOBGSA-N |
| Molecular Weight |
181.279 g/mol |
| SMILES |
C1CCC(CC1)C(=O)\C=C\N(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.927022 |
