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5-(1-Ethoxybuta-1,3-dienyl)-1-(toluene-4-sulfonyl)-2,3-dihydro-1H-pyrrole
SpectraBase Compound ID 8id7Hd9b6oC
InChI InChI=1S/C17H21NO3S/c1-4-7-17(21-5-2)16-8-6-13-18(16)22(19,20)15-11-9-14(3)10-12-15/h4,7-12H,1,5-6,13H2,2-3H3/b17-7-
InChIKey KPWRGSPVJHDADG-IDUWFGFVSA-N
Mol Weight 319.42 g/mol
Molecular Formula C17H21NO3S
Exact Mass 319.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HbpbjsrY2rh
Name 5-(1-Ethoxybuta-1,3-dienyl)-1-(toluene-4-sulfonyl)-2,3-dihydro-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO3S
InChI InChI=1S/C17H21NO3S/c1-4-7-17(21-5-2)16-8-6-13-18(16)22(19,20)15-11-9-14(3)10-12-15/h4,7-12H,1,5-6,13H2,2-3H3/b17-7-
InChIKey KPWRGSPVJHDADG-IDUWFGFVSA-N
Molecular Weight 319.419 g/mol
SMILES C1N(C(=CC1)\C(=C\C=C)OCC)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-01ox-9401000000-aa4c4ec8a585ec81f609
Source of Spectrum F-68-9736-25
Synonyms 5-[(1Z)-1-ethoxy-1,3-butadienyl]-1-[(4-methylphenyl)sulfonyl]-2,3-dihydro-1H-pyrrole Ethyl (1Z)-1-{1-[(4-methylphenyl)sulfonyl]-4,5-dihydro-1H-pyrrol-2-yl}-1,3-butadienyl ether
Wiley ID 1573909