| SpectraBase Spectrum ID |
9sEcSyjoF8p |
| Name |
2-(1'-Cyano-1'-phenylmethylidene)-5,6-dimethyl-3-(3'',4''-dimethylphenyl)imino-2,3-dihydro-1H-indole |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
377.189197753 u |
| Formula |
C26H23N3 |
| InChI |
InChI=1S/C26H23N3/c1-16-10-11-21(12-17(16)2)28-25-22-13-18(3)19(4)14-24(22)29-26(25)23(15-27)20-8-6-5-7-9-20/h5-14,29H,1-4H3/b26-23+,28-25+ |
| InChIKey |
VRCUXHAXPXZDTC-AXWXSEEYSA-N |
| Molecular Weight |
377.491 g/mol |
| SMILES |
C=12\C(\C(NC1C=C(C(=C2)C)C)=C\(C#N)C=1C=CC=CC1)=N\C=1C=C(C)C(=CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.809993 |
