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{4,4-Dimethyl-2-[2'-oxo-2'-(4"-<methanosulfonylamino>phenyl)ethylidene]-pyrrolidin-1'-yl}acetic acid
SpectraBase Compound ID JqkA9sanfTe
InChI InChI=1S/C17H22N2O5S/c1-17(2)9-14(19(11-17)10-16(21)22)8-15(20)12-4-6-13(7-5-12)18-25(3,23)24/h4-8,18H,9-11H2,1-3H3,(H,21,22)/b14-8+
InChIKey VVLBHFTZSYZRDS-RIYZIHGNSA-N
Mol Weight 366.43 g/mol
Molecular Formula C17H22N2O5S
Exact Mass 366.124943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FTBIkV2t93
Name {4,4-Dimethyl-2-[2'-oxo-2'-(4"-phenyl)ethylidene]-pyrrolidin-1'-yl}acetic acid
Alternate Name(s) [2-[2-(4-Methanesufonylamino-phenyl)-2-oxo-ethylidene]-4,4-dimethylpyrrolidin-1-yl]-acetic acid 2-[(2E)-2-[2-[4-(methanesulfonamido)phenyl]-2-oxoethylidene]-4,4-dimethyl-1-pyrrolidinyl]acetic acid 2-[(2E)-2-[2-[4-(methanesulfonamido)phenyl]-2-oxoethylidene]-4,4-dimethylpyrrolidin-1-yl]acetic acid 2-[(2E)-2-[2-[4-(methanesulfonamido)phenyl]-2-oxo-ethylidene]-4,4-dimethyl-pyrrolidin-1-yl]acetic acid (E)-2-(4,4-dimethyl-2-(2-(4-(methylsulfonamido)phenyl)-2-oxoethylidene)pyrrolidin-1-yl)acetic acid 2-[(2E)-4,4-dimethyl-2-[2-[4-(methylsulfonylamino)phenyl]-2-oxidanylidene-ethylidene]pyrrolidin-1-yl]ethanoic acid
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Formula C17H22N2O5S
InChI InChI=1S/C17H22N2O5S/c1-17(2)9-14(19(11-17)10-16(21)22)8-15(20)12-4-6-13(7-5-12)18-25(3,23)24/h4-8,18H,9-11H2,1-3H3,(H,21,22)/b14-8+
InChIKey VVLBHFTZSYZRDS-RIYZIHGNSA-N
Literature Reference DOI 10.1002/ardp.19973300307
Molecular Weight 366.432 g/mol
SMILES N(c1ccc(C(\C=C/2N(CC(=O)O)CC(C2)(C)C)=O)cc1)S(=O)(=O)C
SPLASH splash10-0a4i-2109000000-34303600365f6d35086e
Source of Spectrum APP-330-79-4l
Wiley ID 1770170