| SpectraBase Spectrum ID |
6e803RXpaSZ |
| Name |
S-ethyl 4-cyanobenzothioate |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
191.040485087 u |
| Formula |
C10H9NOS |
| GC Column |
Agilent 190915-433UI (30 m x 250 microm, film thickness 0.25 micrometer) |
| GC Oven Program |
Oven temp 320oC |
| InChI |
InChI=1S/C10H9NOS/c1-2-13-10(12)9-5-3-8(7-11)4-6-9/h3-6H,2H2,1H3 |
| InChIKey |
QJTWZMGDGWFPJB-UHFFFAOYSA-N |
| Instrument Name |
Agilent 8890-5977B |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202202212 |
| Molecular Weight |
191.248 g/mol |
| Quality |
89 |
| SMILES |
C(C)SC(C1=CC=C(C=C1)C#N)=O |
| SPLASH |
splash10-001i-0900000000-0f7929bbc1224e021a37 |
| Source of Spectrum |
QE-28-SM62-1C (DOI: 10.1002/chem.202202212) |
| Thin-Layer Chromatography |
0.30 (nHex/Et2O, 9:1) |
| Wiley ID |
1902351 |
