SpectraBase Spectrum ID |
4dMYURnjTXI |
Name |
3-[2-(Ethylsulfinyl)benzoyl]pyrrole |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H13NO2S |
InChI |
InChI=1S/C13H13NO2S/c1-2-17(16)12-6-4-3-5-11(12)13(15)10-7-8-14-9-10/h3-9,14H,2H2,1H3 |
InChIKey |
MFWLMPZPAGQOOV-UHFFFAOYSA-N |
Molecular Weight |
247.312 g/mol |
SMILES |
[nH]1ccc(c1)C(c1c(S(=O)CC)cccc1)=O |
SPLASH |
splash10-0006-9000000000-1b31292c65e03afbec61 |
Source of Spectrum |
J-59-8079-8 |
Synonyms |
[2-(ethylsulfinyl)phenyl](1H-pyrrol-3-yl)methanone |
Wiley ID |
1249916 |