| SpectraBase Spectrum ID |
Be9ymuvCBMc |
| Name |
2-(3-Chloro-2-hydroxyprop-1-ylsulfanyl)-5-(1H-indol-2-yl)-1,3,4-oxadiazole |
| Appearance |
Colorless crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H12ClN3O2S |
| InChI |
InChI=1S/C13H12ClN3O2S/c14-6-9(18)7-20-13-17-16-12(19-13)11-5-8-3-1-2-4-10(8)15-11/h1-5,9,15,18H,6-7H2 |
| InChIKey |
UWBXDDSGEOWAPZ-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT312 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2545 |
| Molecular Weight |
309.771 g/mol |
| Reported Formula |
C13H12N3O2SCl |
| SMILES |
[nH]1c2c(cc1-c1nnc(SCC(CCl)O)o1)cccc2 |
| SPLASH |
splash10-01ox-7900000000-ac6719f1c85c1f04ce73 |
| Source of Spectrum |
Y-54-SM16-8 |
| Thin-Layer Chromatography |
Rf = 0.18 (EA/n-hexane, 3:7) |
| Wiley ID |
1877750 |
