SpectraBase Spectrum ID |
A8CmrHCVsGh |
Name |
[2-(ethylthio)phenyl]-(1H-pyrrol-3-yl)methanone |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H13NOS |
InChI |
InChI=1S/C13H13NOS/c1-2-16-12-6-4-3-5-11(12)13(15)10-7-8-14-9-10/h3-9,14H,2H2,1H3 |
InChIKey |
GVNJRUWZKRKHER-UHFFFAOYSA-N |
Molecular Weight |
231.313 g/mol |
SMILES |
[nH]1ccc(c1)C(c1c(SCC)cccc1)=O |
SPLASH |
splash10-0udi-0090000000-962c1c7de81ab1eec89d |
Source of Spectrum |
J-59-8079-7 |
Wiley ID |
1232741 |