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3-[2-(Ethylsulfinyl)benzoyl]pyrrole
SpectraBase Compound ID HudMtUBSriX
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
Mol Weight 247.31 g/mol
Molecular Formula C13H13NO2S
Exact Mass 247.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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