1-[2-(Ethylsulfinyl)benzoyl]pyrrole

SpectraBase Compound ID	80aOyEmXCoQ
InChI	InChI=1S/C13H13NO2S/c1-2-17(16)12-8-4-3-7-11(12)13(15)14-9-5-6-10-14/h3-10H,2H2,1H3
InChIKey	SESJMACKXBPNMN-UHFFFAOYSA-N Google Search
Mol Weight	247.31 g/mol
Molecular Formula	C13H13NO2S
Exact Mass	247.0667 g/mol

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SpectraBase Spectrum ID	51I1CTXvAlg
Name	1-[2-(Ethylsulfinyl)benzoyl]pyrrole
Alternate Name(s)	1-[2-(ethylsulfinyl)benzoyl]-1H-pyrrole Ethyl 2-(1H-pyrrol-1-ylcarbonyl)phenyl sulfoxide (2-ethylsulfinylphenyl)-(1-pyrrolyl)methanone (2-ethylsulfinylphenyl)-pyrrol-1-ylmethanone
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H13NO2S
InChI	InChI=1S/C13H13NO2S/c1-2-17(16)12-8-4-3-7-11(12)13(15)14-9-5-6-10-14/h3-10H,2H2,1H3
InChIKey	SESJMACKXBPNMN-UHFFFAOYSA-N
Molecular Weight	247.312 g/mol
SMILES	c1(C([n]2cccc2)=O)c(S(=O)CC)cccc1
SPLASH	splash10-0ue9-0900000000-cc9de75cfbd1df58ee17
Source of Spectrum	J-57-3679-5
Wiley ID	1249914