| SpectraBase Spectrum ID |
GuQidjWmLj9 |
| Name |
Propanenitrile, 2-[[[4,5-dimethoxy-2-(methylthio)phenyl]methyl]amino]-2-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
280.124549064 u |
| Formula |
C14H20N2O2S |
| InChI |
InChI=1S/C14H20N2O2S/c1-14(2,9-15)16-8-10-6-11(17-3)12(18-4)7-13(10)19-5/h6-7,16H,8H2,1-5H3 |
| InChIKey |
JTSOWZKWXWSQTP-UHFFFAOYSA-N |
| Molecular Weight |
280.386 g/mol |
| SMILES |
C=1(C(=CC(=C(C1)OC)OC)SC)CNC(C#N)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943091 |
![Propanenitrile, 2-[[[4,5-dimethoxy-2-(methylthio)phenyl]methyl]amino]-2-methyl-](/api/spectrum/GuQidjWmLj9/structure.png?h=300&w=458 "Propanenitrile, 2-[[[4,5-dimethoxy-2-(methylthio)phenyl]methyl]amino]-2-methyl-")
