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2-[2-(Ethylsulfinyl)benzoyl]pyrrole
SpectraBase Compound ID GXjXQUnRG1g
InChI InChI=1S/C13H13NO2S/c1-2-17(16)12-8-4-3-6-10(12)13(15)11-7-5-9-14-11/h3-9,14H,2H2,1H3
InChIKey KUVJOLCCKRCZAN-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 806scQ38vhE
Name 2-[2-(Ethylsulfinyl)benzoyl]pyrrole
Alternate Name(s) [2-(ethylsulfinyl)phenyl](1H-pyrrol-2-yl)methanone
Comments Less than 3 mono-isotopic peaks
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Formula C13H13NO2S
InChI InChI=1S/C13H13NO2S/c1-2-17(16)12-8-4-3-6-10(12)13(15)11-7-5-9-14-11/h3-9,14H,2H2,1H3
InChIKey KUVJOLCCKRCZAN-UHFFFAOYSA-N
Molecular Weight 247.312 g/mol
SMILES [nH]1cccc1C(c1c(S(=O)CC)cccc1)=O
SPLASH splash10-014j-0090000000-119c26b2a6a0bf8a2ed0
Source of Spectrum J-59-8079-4
Wiley ID 1249917