| SpectraBase Spectrum ID |
IVGNYqheF0Y |
| Name |
2-(Methylthio)terephthalonitrile |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
174.025169375 u |
| Formula |
C9H6N2S |
| InChI |
InChI=1S/C9H6N2S/c1-12-9-4-7(5-10)2-3-8(9)6-11/h2-4H,1H3 |
| InChIKey |
WNLYDBGDVLPEHN-UHFFFAOYSA-N |
| Instrument Name |
FINNIGAN MAT 95Q or HEWLETT-PACKARD HP 6890-MSD 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202103700 |
| Molecular Weight |
174.221 g/mol |
| Quality |
393 |
| Reported Formula |
C9H6N2S |
| SMILES |
C1=C(C(=CC(=C1)C#N)SC)C#N |
| SPLASH |
splash10-00dl-0900000000-97bddcad0959437e0695 |
| Source of Spectrum |
QE-28-SM69-4s (DOI: 10.1002/chem.202103700) |
| Wiley ID |
1898243 |
