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1-Tosyl-1H-pyrrole-2-carbaldehyde

View entire compound with spectra: 2 MS (GC)

1-Tosyl-1H-pyrrole-2-carbaldehyde
SpectraBase Compound ID 17SAJDecScq
InChI InChI=1S/C12H11NO3S/c1-10-4-6-12(7-5-10)17(15,16)13-8-2-3-11(13)9-14/h2-9H,1H3
InChIKey PJJJROQSNDRWIU-UHFFFAOYSA-N
Mol Weight 249.28 g/mol
Molecular Formula C12H11NO3S
Exact Mass 249.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IUYtaA2Q97i
Name 1-(4-Methylphenyl)sulfonyl-2-pyrrolecarboxaldehyde
Alternate Name(s) 1-(4-Methylphenyl)sulfonylpyrrole-2-carbaldehyde 1-(p-tolylsulfonyl)pyrrole-2-carbaldehyde 1-Tosylpyrrole-2-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO3S
InChI InChI=1S/C12H11NO3S/c1-10-4-6-12(7-5-10)17(15,16)13-8-2-3-11(13)9-14/h2-9H,1H3
InChIKey PJJJROQSNDRWIU-UHFFFAOYSA-N
Molecular Weight 249.284 g/mol
SMILES c1([n](S(c2ccc(cc2)C)(=O)=O)ccc1)C=O
SPLASH splash10-0006-9100000000-ac85cdc4f75cc71ed824
Source of Spectrum H-77-1408-5
Wiley ID 1252034