| SpectraBase Spectrum ID |
2J36yqqeFgF |
| Name |
(2E)-2-[1-(3-Chloropropyl)piperidin-2-ylidene]acetonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
198.092376191 u |
| Formula |
C10H15ClN2 |
| InChI |
InChI=1S/C10H15ClN2/c11-6-3-9-13-8-2-1-4-10(13)5-7-12/h5H,1-4,6,8-9H2/b10-5+ |
| InChIKey |
CWBNVZRJUDFAQW-BJMVGYQFSA-N |
| Molecular Weight |
198.697 g/mol |
| SMILES |
C(#N)\C=C/1N(CCCC1)CCCCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962007 |
![(2E)-2-[1-(3-chloropropyl)piperidin-2-ylidene]acetonitrile](/api/spectrum/2J36yqqeFgF/structure.png?h=300&w=458 "(2E)-2-[1-(3-chloropropyl)piperidin-2-ylidene]acetonitrile")
