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Methyl 8-oxo-8-[1'-(phenylsulfonyl)-1H-pyrrol-3'-yl]-octanoate
SpectraBase Compound ID 5uTOplftgVq
InChI InChI=1S/C19H23NO5S/c1-25-19(22)12-8-3-2-7-11-18(21)16-13-14-20(15-16)26(23,24)17-9-5-4-6-10-17/h4-6,9-10,13-15H,2-3,7-8,11-12H2,1H3
InChIKey AXPLZYQQCDOOOE-UHFFFAOYSA-N
Mol Weight 377.46 g/mol
Molecular Formula C19H23NO5S
Exact Mass 377.129694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IAJUNvrI8u3
Name Methyl 8-oxo-8-[1'-(phenylsulfonyl)-1H-pyrrol-3'-yl]-octanoate
Alternate Name(s) Methyl 8-oxo-8-[1-(phenylsulfonyl)-1H-pyrrol-3-yl]octanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23NO5S
InChI InChI=1S/C19H23NO5S/c1-25-19(22)12-8-3-2-7-11-18(21)16-13-14-20(15-16)26(23,24)17-9-5-4-6-10-17/h4-6,9-10,13-15H,2-3,7-8,11-12H2,1H3
InChIKey AXPLZYQQCDOOOE-UHFFFAOYSA-N
Molecular Weight 377.455 g/mol
SMILES c1[n](S(=O)(=O)c2ccccc2)ccc1C(=O)CCCCCCC(=O)OC
SPLASH splash10-0035-5290000000-f60061c72b1fd498c180
Source of Spectrum C-88-2475-5
Wiley ID 1590378