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rac-2-(But-3-en-1-yl)-2-(3,4-dimethoxyphenyl)pyrrolidin-3-one
SpectraBase Compound ID GBZVVgzs7k9
InChI InChI=1S/C16H21NO3/c1-4-5-9-16(15(18)8-10-17-16)12-6-7-13(19-2)14(11-12)20-3/h4,6-7,11,17H,1,5,8-10H2,2-3H3
InChIKey JRKUICNHTIAZND-UHFFFAOYSA-N
Mol Weight 275.35 g/mol
Molecular Formula C16H21NO3
Exact Mass 275.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E7joeDdDKgf
Name rac-2-(But-3-en-1-yl)-2-(3,4-dimethoxyphenyl)pyrrolidin-3-one
Appearance Red brown oil
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Formula C16H21NO3
InChI InChI=1S/C16H21NO3/c1-4-5-9-16(15(18)8-10-17-16)12-6-7-13(19-2)14(11-12)20-3/h4,6-7,11,17H,1,5,8-10H2,2-3H3
InChIKey JRKUICNHTIAZND-UHFFFAOYSA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201801479
Molecular Weight 275.348 g/mol
Reported Formula C16H21NO3
SMILES N1CCC(C1(CCC=C)c1cc(c(cc1)OC)OC)=O
SPLASH splash10-00kb-0390000000-50f3ac72fbeb85fb1bfc
Source of Spectrum U1-2019-144-3
Wiley ID 1843585