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3-(ORTHO-NITROPHENYL)-2-STYRYL-1-TOSYLPYRROLE
SpectraBase Compound ID 3XzYfvfu7gq
InChI InChI=1S/C25H20N2O4S/c1-19-11-14-21(15-12-19)32(30,31)26-18-17-23(22-9-5-6-10-25(22)27(28)29)24(26)16-13-20-7-3-2-4-8-20/h2-18H,1H3/b16-13+
InChIKey ODLSAMZEOIACGL-DTQAZKPQSA-N
Mol Weight 444.51 g/mol
Molecular Formula C25H20N2O4S
Exact Mass 444.114378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HXeNgAHPDe1
Name 3-(o-Nitrophenyl)-2-styryl-1-tosylpyrrole
Alternate Name(s) 1-[(4-methylphenyl)sulfonyl]-3-(2-nitrophenyl)-2-[(E)-2-phenylethenyl]-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20N2O4S
InChI InChI=1S/C25H20N2O4S/c1-19-11-14-21(15-12-19)32(30,31)26-18-17-23(22-9-5-6-10-25(22)27(28)29)24(26)16-13-20-7-3-2-4-8-20/h2-18H,1H3/b16-13+
InChIKey ODLSAMZEOIACGL-DTQAZKPQSA-N
Molecular Weight 444.505 g/mol
SMILES c1([n](S(c2ccc(cc2)C)(=O)=O)ccc1-c1c(N(=O)=O)cccc1)\C=C\c1ccccc1
SPLASH splash10-0006-0030900000-208c1b694294452c9865
Source of Spectrum I-79-1834-10
Wiley ID 812999