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Ethyl [(p-methylphenyl)sulfonyl]-[1'-(3''-acetoxypropyl)pyrrolidin-2'-ylidene)acetate
SpectraBase Compound ID BbBmZn0lMIm
InChI InChI=1S/C20H27NO6S/c1-4-26-20(23)19(28(24,25)17-10-8-15(2)9-11-17)18-7-5-12-21(18)13-6-14-27-16(3)22/h8-11H,4-7,12-14H2,1-3H3/b19-18+
InChIKey QTCOMULDHQCHDG-VHEBQXMUSA-N
Mol Weight 409.5 g/mol
Molecular Formula C20H27NO6S
Exact Mass 409.155909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EShBnbrqPQq
Name Ethyl [(p-methylphenyl)sulfonyl]-[1'-(3''-acetoxypropyl)pyrrolidin-2'-ylidene)acetate
Alternate Name(s) Ethyl-2-[(p-methylphenyl)sulfonyl]-2-[1'-(3''-acetoxypropyl)pyrrolidin-2'-ylidene]acetate (E)-ethyl 2-(1-(3-acetoxypropyl)pyrrolidin-2-ylidene)-2-tosylacetate (2E)-2-[1-(3-acetyloxypropyl)-2-pyrrolidinylidene]-2-(4-methylphenyl)sulfonylacetic acid ethyl ester Ethyl (2E)-2-[1-(3-acetyloxypropyl)pyrrolidin-2-ylidene]-2-(4-methylphenyl)sulfonylacetate Ethyl (2E)-2-[1-(3-acetoxypropyl)pyrrolidin-2-ylidene]-2-(p-tolylsulfonyl)acetate Ethyl (2E)-2-[1-(3-acetyloxypropyl)pyrrolidin-2-ylidene]-2-(4-methylphenyl)sulfonyl-ethanoate
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Formula C20H27NO6S
InChI InChI=1S/C20H27NO6S/c1-4-26-20(23)19(28(24,25)17-10-8-15(2)9-11-17)18-7-5-12-21(18)13-6-14-27-16(3)22/h8-11H,4-7,12-14H2,1-3H3/b19-18+
InChIKey QTCOMULDHQCHDG-VHEBQXMUSA-N
Molecular Weight 409.497 g/mol
SMILES C(N1\C(=C/(S(c2ccc(C)cc2)(=O)=O)C(=O)OCC)CCC1)CCOC(=O)C
SPLASH splash10-0gb9-0912000000-9486ed721f25617e259e
Source of Spectrum F5-2-3513-11
Wiley ID 1732103