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3-{2'-[(p-Methylphenylsulfonyl)methylene]-pyrrolidin-1'-yl}propyl Acetate
SpectraBase Compound ID 7MUqcsoBSQ3
InChI InChI=1S/C17H23NO4S/c1-14-6-8-17(9-7-14)23(20,21)13-16-5-3-10-18(16)11-4-12-22-15(2)19/h6-9,13H,3-5,10-12H2,1-2H3/b16-13+
InChIKey WGZQZOZLUNTVHI-DTQAZKPQSA-N
Mol Weight 337.43 g/mol
Molecular Formula C17H23NO4S
Exact Mass 337.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jqyKpf5DKR
Name 3-{2'-[(p-Methylphenylsulfonyl)methylene]-pyrrolidin-1'-yl}propyl Acetate
Alternate Name(s) (E)-3-(2-(tosylmethylene)pyrrolidin-1-yl)propyl acetate Acetic acid 3-[(2E)-2-[(4-methylphenyl)sulfonylmethylidene]-1-pyrrolidinyl]propyl ester 3-[(2E)-2-[(4-methylphenyl)sulfonylmethylidene]pyrrolidin-1-yl]propyl acetate 3-[(2E)-2-(p-tolylsulfonylmethylene)pyrrolidin-1-yl]propyl acetate 3-[(2E)-2-[(4-methylphenyl)sulfonylmethylidene]pyrrolidin-1-yl]propyl ethanoate
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Formula C17H23NO4S
InChI InChI=1S/C17H23NO4S/c1-14-6-8-17(9-7-14)23(20,21)13-16-5-3-10-18(16)11-4-12-22-15(2)19/h6-9,13H,3-5,10-12H2,1-2H3/b16-13+
InChIKey WGZQZOZLUNTVHI-DTQAZKPQSA-N
Molecular Weight 337.434 g/mol
SMILES C(N1\C(=C\S(c2ccc(cc2)C)(=O)=O)CCC1)CCOC(=O)C
SPLASH splash10-0092-8960000000-38aeab112b6cfe0a50ba
Source of Spectrum F5-2-3513-16
Wiley ID 1732099