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Diethyl 2-(1-benzyl-trans-4-(1-bromovinyl)-2-oxopyrrolidin-3-yl)malonate
SpectraBase Compound ID R3WClma0tN
InChI InChI=1S/C20H24BrNO5/c1-4-26-19(24)17(20(25)27-5-2)16-15(13(3)21)12-22(18(16)23)11-14-9-7-6-8-10-14/h6-10,15-17H,3-5,11-12H2,1-2H3/t15-,16+/m0/s1
InChIKey PEYDGHIXBKRQBI-JKSUJKDBSA-N
Mol Weight 438.32 g/mol
Molecular Formula C20H24BrNO5
Exact Mass 437.083786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DyUAD8I4WYm
Name Diethyl 2-(1-benzyl-trans-4-(1-bromovinyl)-2-oxopyrrolidin-3-yl)malonate
Alternate Name(s) Diethyl 2-((3S,4S)-1-benzyl-4-(1-bromovinyl)-2-oxopyrrolidin-3-yl)malonate
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Formula C20H24BrNO5
InChI InChI=1S/C20H24BrNO5/c1-4-26-19(24)17(20(25)27-5-2)16-15(13(3)21)12-22(18(16)23)11-14-9-7-6-8-10-14/h6-10,15-17H,3-5,11-12H2,1-2H3/t15-,16+/m0/s1
InChIKey PEYDGHIXBKRQBI-JKSUJKDBSA-N
Literature Reference DOI 10.1039/c4ob00233d
Molecular Weight 438.318 g/mol
SMILES [C@@]1(C(=C)Br)([H])CN(C(=O)[C@]1(C(C(=O)OCC)C(OCC)=O)[H])Cc1ccccc1
SPLASH splash10-052u-9082800000-0d3e2703a04efc25a80a
Source of Spectrum F5-12-3971-12b
Wiley ID 1747469