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2-FORMYL-3-THIOPHENYL-1-TOSYLPYRROLE
SpectraBase Compound ID 73RtOJmByFu
InChI InChI=1S/C16H13NO3S2/c1-12-4-6-13(7-5-12)22(19,20)17-9-8-14(15(17)11-18)16-3-2-10-21-16/h2-11H,1H3
InChIKey AZQOWMRWNTUCOA-UHFFFAOYSA-N
Mol Weight 331.4 g/mol
Molecular Formula C16H13NO3S2
Exact Mass 331.033686 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hwqdOKRGK2
Name 3-(Thiophenyl)-2-formyl-1-tosylpyrrole
Alternate Name(s) 1-[(4-methylphenyl)sulfonyl]-3-(2-thienyl)-1H-pyrrole-2-carbaldehyde
Comments Less than 3 mono-isotopic peaks
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Formula C16H13NO3S2
InChI InChI=1S/C16H13NO3S2/c1-12-4-6-13(7-5-12)22(19,20)17-9-8-14(15(17)11-18)16-3-2-10-21-16/h2-11H,1H3
InChIKey AZQOWMRWNTUCOA-UHFFFAOYSA-N
Molecular Weight 331.404 g/mol
SMILES c1([n](S(c2ccc(cc2)C)(=O)=O)ccc1-c1sccc1)C=O
SPLASH splash10-0059-0908000000-c984e6284753f881e13b
Source of Spectrum I-79-1837-13
Wiley ID 812989