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3-(3,4-Dichlorophenyl)-5-methyl-1-phenyl-2-(phenylthio) pyrrole
SpectraBase Compound ID AhYVgjJIBu6
InChI InChI=1S/C23H17Cl2NS/c1-16-14-20(17-12-13-21(24)22(25)15-17)23(27-19-10-6-3-7-11-19)26(16)18-8-4-2-5-9-18/h2-15H,1H3
InChIKey QDPNOPYPABYLLY-UHFFFAOYSA-N
Mol Weight 410.36 g/mol
Molecular Formula C23H17Cl2NS
Exact Mass 409.045876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LoQP6RK7GJq
Name 3-(3,4-Dichlorophenyl)-5-methyl-1-phenyl-2-(phenylthio) pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17Cl2NS
InChI InChI=1S/C23H17Cl2NS/c1-16-14-20(17-12-13-21(24)22(25)15-17)23(27-19-10-6-3-7-11-19)26(16)18-8-4-2-5-9-18/h2-15H,1H3
InChIKey QDPNOPYPABYLLY-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol070205d
Molecular Weight 410.362 g/mol
SMILES c1(c(cc(cc1)-c1c([n](-c2ccccc2)c(C)c1)Sc1ccccc1)Cl)Cl
SPLASH splash10-08fr-1010900000-1f3348d50ab10b5fca08
Source of Spectrum A1-9-1445/SMS6-2c
Synonyms 3-(3,4-dichlorophenyl)-5-methyl-1-phenyl-2-(phenylthio)-1H-pyrrole
Wiley ID 1758021