| SpectraBase Spectrum ID |
ISWyhd02iz |
| Name |
1H-Indene-1-carbonitrile, 2,3-dihydro-1,3,3-trimethyl-2-(methylimino)-, (Z)-(.+-.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
212.131348523 u |
| Formula |
C14H16N2 |
| InChI |
InChI=1S/C14H16N2/c1-13(2)10-7-5-6-8-11(10)14(3,9-15)12(13)16-4/h5-8H,1-4H3/b16-12- |
| InChIKey |
PTZPOFHTWOIDIJ-VBKFSLOCSA-N |
| Molecular Weight |
212.296 g/mol |
| SMILES |
C1(\C(C(C)(C)C2=C1C=CC=C2)=N/C)(C#N)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953714 |
