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t-Butyl (2S,3R)-3-(2'-oxopyrrolidin-1'-yl)-2-ethylhexanoate
SpectraBase Compound ID Iis3Fjj9Ov3
InChI InChI=1S/C16H29NO3/c1-6-9-13(17-11-8-10-14(17)18)12(7-2)15(19)20-16(3,4)5/h12-13H,6-11H2,1-5H3/t12-,13+/m0/s1
InChIKey LQXBCPUHXFOUDC-QWHCGFSZSA-N
Mol Weight 283.41 g/mol
Molecular Formula C16H29NO3
Exact Mass 283.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CvBNqnGG6lW
Name t-Butyl (2S,3R)-3-(2'-oxopyrrolidin-1'-yl)-2-ethylhexanoate
Alternate Name(s) (2S,3R)-tert-butyl 2-ethyl-3-(2-oxopyrrolidin-1-yl)hexanoate (2S,3R)-2-ethyl-3-(2-oxo-1-pyrrolidinyl)hexanoic acid tert-butyl ester tert-Butyl (2S,3R)-2-ethyl-3-(2-oxopyrrolidin-1-yl)hexanoate tert-Butyl (2S,3R)-2-ethyl-3-(2-oxidanylidenepyrrolidin-1-yl)hexanoate
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Formula C16H29NO3
InChI InChI=1S/C16H29NO3/c1-6-9-13(17-11-8-10-14(17)18)12(7-2)15(19)20-16(3,4)5/h12-13H,6-11H2,1-5H3/t12-,13+/m0/s1
InChIKey LQXBCPUHXFOUDC-QWHCGFSZSA-N
Molecular Weight 283.412 g/mol
SMILES [C@@](N1C(=O)CCC1)([C@@](C(OC(C)(C)C)=O)(CC)[H])(CCC)[H]
SPLASH splash10-0006-2910000000-4d9f65964efa8f3e0661
Source of Spectrum F5-3-842-18b
Wiley ID 1732185