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(3R)-3-[(2E)-2-(2-ethoxy-2-keto-ethylidene)pyrrolidino]caprylic acid tert-butyl ester
SpectraBase Compound ID 286ag6TFHjU
InChI InChI=1S/C20H35NO4/c1-6-8-9-11-16(15-19(23)25-20(3,4)5)21-13-10-12-17(21)14-18(22)24-7-2/h14,16H,6-13,15H2,1-5H3/b17-14+/t16-/m1/s1
InChIKey FZOKLFFFYOMIBF-WECAROLCSA-N
Mol Weight 353.5 g/mol
Molecular Formula C20H35NO4
Exact Mass 353.256609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KbZHRtyNJUC
Name (3R)-3-[(2E)-2-(2-ethoxy-2-keto-ethylidene)pyrrolidino]caprylic acid tert-butyl ester
Alternate Name(s) (3R)-3-[(2E)-2-(2-ethoxy-2-oxoethylidene)-1-pyrrolidinyl]octanoic acid tert-butyl ester tert-Butyl (3R)-3-[(2E)-2-(2-ethoxy-2-oxidanylidene-ethylidene)pyrrolidin-1-yl]octanoate tert-Butyl (3R)-3-[(2E)-2-(2-ethoxy-2-oxo-ethylidene)pyrrolidin-1-yl]octanoate
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Formula C20H35NO4
InChI InChI=1S/C20H35NO4/c1-6-8-9-11-16(15-19(23)25-20(3,4)5)21-13-10-12-17(21)14-18(22)24-7-2/h14,16H,6-13,15H2,1-5H3/b17-14+/t16-/m1/s1
InChIKey FZOKLFFFYOMIBF-WECAROLCSA-N
Molecular Weight 353.503 g/mol
SMILES C(\C=C\1N([C@@](CC(OC(C)(C)C)=O)(CCCCC)[H])CCC1)(=O)OCC
SPLASH splash10-0bu0-1791000000-9288b24492b0db0fdcb0
Source of Spectrum KC-0-1927-32
Wiley ID 831106