| SpectraBase Spectrum ID |
D9KCm5yjCGx |
| Name |
(S)-N-(3-Pyridylmethylidene)-1-phenylethanamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
210.115698459 u |
| Formula |
C14H14N2 |
| InChI |
InChI=1S/C14H14N2/c1-12(14-7-3-2-4-8-14)16-11-13-6-5-9-15-10-13/h2-12H,1H3/b16-11+/t12-/m0/s1 |
| InChIKey |
RVFLQLXXNNHUFK-JASJWYONSA-N |
| Molecular Weight |
210.280 g/mol |
| SMILES |
C=1(\C=N\[C@](C=2C=CC=CC2)(C)[H])C=NC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919285 |
