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3,4-bis(methoxymethyl)-1-[(4-methylphenyl)sulfonyl]-2-phenyl-1H-pyrrole
SpectraBase Compound ID 4pvoMaz2O2f
InChI InChI=1S/C21H23NO4S/c1-16-9-11-19(12-10-16)27(23,24)22-13-18(14-25-2)20(15-26-3)21(22)17-7-5-4-6-8-17/h4-13H,14-15H2,1-3H3
InChIKey NJWFBIWUOFEKFL-UHFFFAOYSA-N
Mol Weight 385.48 g/mol
Molecular Formula C21H23NO4S
Exact Mass 385.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Omo1ATLLPx
Name 3,4-bis(methoxymethyl)-1-[(4-methylphenyl)sulfonyl]-2-phenyl-1H-pyrrole
Alternate Name(s) N-Tosyl-2-phenyl-3,4-dimethoxymethyl-pyrrole N-Tosyl-3,4-dimethoxymethylpyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO4S
InChI InChI=1S/C21H23NO4S/c1-16-9-11-19(12-10-16)27(23,24)22-13-18(14-25-2)20(15-26-3)21(22)17-7-5-4-6-8-17/h4-13H,14-15H2,1-3H3
InChIKey NJWFBIWUOFEKFL-UHFFFAOYSA-N
Molecular Weight 385.478 g/mol
SMILES c1(S([n]2c(c(COC)c(c2)COC)-c2ccccc2)(=O)=O)ccc(cc1)C
SPLASH splash10-0002-0904000000-f09fbbb84269e90624a5
Source of Spectrum C-119-1426-9
Wiley ID 760245