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(E)-2-(2S,6R)-(6-Styryltetrahydro-2H-pyran-2-yl)-1-tosyl-1H-pyrrole
SpectraBase Compound ID 3NaPpiwlJUB
InChI InChI=1S/C24H25NO3S/c1-19-12-16-22(17-13-19)29(26,27)25-18-6-10-23(25)24-11-5-9-21(28-24)15-14-20-7-3-2-4-8-20/h2-4,6-8,10,12-18,21,24H,5,9,11H2,1H3/b15-14+/t21-,24+/m1/s1
InChIKey ZHMLYLBOHPLNPC-BDMZBUNLSA-N
Mol Weight 407.53 g/mol
Molecular Formula C24H25NO3S
Exact Mass 407.155515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FqykXiBHhJ
Name (E)-2-(2S,6R)-(6-Styryltetrahydro-2H-pyran-2-yl)-1-tosyl-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H25NO3S
InChI InChI=1S/C24H25NO3S/c1-19-12-16-22(17-13-19)29(26,27)25-18-6-10-23(25)24-11-5-9-21(28-24)15-14-20-7-3-2-4-8-20/h2-4,6-8,10,12-18,21,24H,5,9,11H2,1H3/b15-14+/t21-,24+/m1/s1
InChIKey ZHMLYLBOHPLNPC-BDMZBUNLSA-N
Literature Reference DOI 10.1021/acs.joc.5b02371
Molecular Weight 407.528 g/mol
SMILES [C@@]1(CCC[C@@](O1)(\C=C\c1ccccc1)[H])(c1ccc[n]1S(c1ccc(cc1)C)(=O)=O)[H]
SPLASH splash10-000x-9500000000-530f36f2d580dbddcb8a
Source of Spectrum J-80-12522-18i
Synonyms 2-((2S,6R)-6-((E)-styryl)tetrahydro-2H-pyran-2-yl)-1-tosyl-1H-pyrrole
Wiley ID 1801826