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(E)-1-(1-besylpyrrol-3-yl)-3-(1,3-dioxan-2-yl)prop-2-en-1-one
SpectraBase Compound ID FgeTDITujW0
InChI InChI=1S/C17H17NO5S/c19-16(7-8-17-22-11-4-12-23-17)14-9-10-18(13-14)24(20,21)15-5-2-1-3-6-15/h1-3,5-10,13,17H,4,11-12H2/b8-7+
InChIKey DOCQSWBCEJORRS-BQYQJAHWSA-N
Mol Weight 347.39 g/mol
Molecular Formula C17H17NO5S
Exact Mass 347.082744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1oWS8lRlxh
Name (E)-1-(1-besylpyrrol-3-yl)-3-(1,3-dioxan-2-yl)prop-2-en-1-one
Alternate Name(s) (E)-1-[1-(benzenesulfonyl)-3-pyrrolyl]-3-(1,3-dioxan-2-yl)-2-propen-1-one (E)-1-[1-(benzenesulfonyl)pyrrol-3-yl]-3-(1,3-dioxan-2-yl)prop-2-en-1-one (E)-3-(1,3-dioxan-2-yl)-1-[1-(phenylsulfonyl)pyrrol-3-yl]prop-2-en-1-one
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Formula C17H17NO5S
InChI InChI=1S/C17H17NO5S/c19-16(7-8-17-22-11-4-12-23-17)14-9-10-18(13-14)24(20,21)15-5-2-1-3-6-15/h1-3,5-10,13,17H,4,11-12H2/b8-7+
InChIKey DOCQSWBCEJORRS-BQYQJAHWSA-N
Molecular Weight 347.385 g/mol
SMILES c1[n](ccc1C(\C=C\C1OCCCO1)=O)S(=O)(=O)c1ccccc1
SPLASH splash10-002s-9311000000-a17b05222657b722126f
Source of Spectrum E1-43-43-17
Wiley ID 1552869