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Diethyl {1-Methoxyethoxy-2-[1-(toluene-4-sulfonyl)-1H-pyrrol-3-yl]vinyl}phosphonate
SpectraBase Compound ID UpWJ1kzx85
InChI InChI=1S/C20H28NO7PS/c1-6-26-29(22,27-7-2)20(28-17(4)25-5)14-18-12-13-21(15-18)30(23,24)19-10-8-16(3)9-11-19/h8-15,17H,6-7H2,1-5H3/b20-14+
InChIKey RWCDOOUHTOHBQO-XSFVSMFZSA-N
Mol Weight 457.48 g/mol
Molecular Formula C20H28NO7PS
Exact Mass 457.13241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8S9Yl1Av6Im
Name Diethyl {1-Methoxyethoxy-2-[1-(toluene-4-sulfonyl)-1H-pyrrol-3-yl]vinyl}phosphonate
Alternate Name(s) Diethyl (E)-1-(1-methoxyethoxy)-2-{1-[(4-methylphenyl)sulfonyl]-1H-pyrrol-3-yl}ethenylphosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28NO7PS
InChI InChI=1S/C20H28NO7PS/c1-6-26-29(22,27-7-2)20(28-17(4)25-5)14-18-12-13-21(15-18)30(23,24)19-10-8-16(3)9-11-19/h8-15,17H,6-7H2,1-5H3/b20-14+
InChIKey RWCDOOUHTOHBQO-XSFVSMFZSA-N
Molecular Weight 457.478 g/mol
SMILES c1[n](S(c2ccc(cc2)C)(=O)=O)ccc1\C=C\(P(=O)(OCC)OCC)OC(OC)C
SPLASH splash10-08fr-0090700000-46674a7f1fb69e611611
Source of Spectrum F4-0-1497-10
Wiley ID 1619689