| SpectraBase Spectrum ID |
90Rdsdre2dR |
| Name |
4-methylthiobenzonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
149.029920403 u |
| Formula |
C8H7NS |
| GC Column |
DB-5 MS fused silica (30 m x 0.25 mm, film thickness 0.25 micrometer) |
| GC Oven Program |
Oven temp 220oC |
| InChI |
InChI=1S/C8H7NS/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,1H3 |
| InChIKey |
RPVGEEHGKIFQFO-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GC-17A-QP5050A or Shimadzu GC-2010-QP2010S |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202102757 |
| Molecular Weight |
149.211 g/mol |
| Quality |
963 |
| SMILES |
CSC1=CC=C(C#N)C=C1 |
| SPLASH |
splash10-0002-4900000000-939363a546fd9026246c |
| Source of Spectrum |
QE-27-SM36-4-methylthiobenzonitrile (DOI: 10.1002/chem.202102757) |
| Wiley ID |
1904172 |
