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2-Phenyl-3,4-bis(phenylthio)-1-tosyl-2,5-dihydro-1H-pyrrole
SpectraBase Compound ID GY3gRAouj0W
InChI InChI=1S/C29H25NO2S3/c1-22-17-19-26(20-18-22)35(31,32)30-21-27(33-24-13-7-3-8-14-24)29(34-25-15-9-4-10-16-25)28(30)23-11-5-2-6-12-23/h2-20,28H,21H2,1H3
InChIKey CUFWOXRGSMWAPV-UHFFFAOYSA-N
Mol Weight 515.7 g/mol
Molecular Formula C29H25NO2S3
Exact Mass 515.104743 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjXKIKMTC1G
Name 2-Phenyl-3,4-bis(phenylthio)-1-tosyl-2,5-dihydro-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H25NO2S3
InChI InChI=1S/C29H25NO2S3/c1-22-17-19-26(20-18-22)35(31,32)30-21-27(33-24-13-7-3-8-14-24)29(34-25-15-9-4-10-16-25)28(30)23-11-5-2-6-12-23/h2-20,28H,21H2,1H3
InChIKey CUFWOXRGSMWAPV-UHFFFAOYSA-N
Molecular Weight 515.704 g/mol
SMILES C1N(C(C(=C1Sc1ccccc1)Sc1ccccc1)c1ccccc1)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-0pbd-4591020000-85b9da3fde84cc0e7b65
Source of Spectrum J-80-7711-7e
Wiley ID 1806804