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(E)-ethyl 4-p-tolyl-2-(1-tosyl-4-vinyl-2,5-dihydro-1H-pyrrol-3-yl)but-3-enoate
SpectraBase Compound ID Bqp7kJyRFZn
InChI InChI=1S/C26H29NO4S/c1-5-22-17-27(32(29,30)23-14-9-20(4)10-15-23)18-25(22)24(26(28)31-6-2)16-13-21-11-7-19(3)8-12-21/h5,7-16,24H,1,6,17-18H2,2-4H3/b16-13+
InChIKey SZKJCLXQIYLNFZ-DTQAZKPQSA-N
Mol Weight 451.58 g/mol
Molecular Formula C26H29NO4S
Exact Mass 451.18173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AAblXRCz4Zi
Name (E)-ethyl 4-p-tolyl-2-(1-tosyl-4-vinyl-2,5-dihydro-1H-pyrrol-3-yl)but-3-enoate
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Formula C26H29NO4S
InChI InChI=1S/C26H29NO4S/c1-5-22-17-27(32(29,30)23-14-9-20(4)10-15-23)18-25(22)24(26(28)31-6-2)16-13-21-11-7-19(3)8-12-21/h5,7-16,24H,1,6,17-18H2,2-4H3/b16-13+
InChIKey SZKJCLXQIYLNFZ-DTQAZKPQSA-N
Literature Reference DOI 10.1021/ol101455c
Molecular Weight 451.581 g/mol
SMILES C1N(CC(C=C)=C1C(\C=C\c1ccc(cc1)C)C(=O)OCC)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-0kkd-3693400000-9900f747f032e2a1890d
Source of Spectrum A1-12-4462/SMS34-(E)_3e
Synonyms (E)-ethyl 4-(p-tolyl)-2-(1-tosyl-4-vinyl-2,5-dihydro-1H-pyrrol-3-yl)but-3-enoate
Wiley ID 1752417