| SpectraBase Spectrum ID |
JlS8ebU652X |
| Name |
(R,Z)-2-Phenylnon-6-enenitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
213.151749616 u |
| Formula |
C15H19N |
| InChI |
InChI=1S/C15H19N/c1-2-3-4-5-7-12-15(13-16)14-10-8-6-9-11-14/h3-4,6,8-11,15H,2,5,7,12H2,1H3/b4-3-/t15-/m0/s1 |
| InChIKey |
AGXFWLIACOJFKQ-JZIMQPMSSA-N |
| Molecular Weight |
213.324 g/mol |
| SMILES |
C([C@](CCC\C=C/CC)(C1=CC=CC=C1)[H])#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.968223 |
