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4-(1',3'-Pentadienyl)-N-(1'-butenyl)-2-pyrrolidinone
SpectraBase Compound ID 7BqxAPpVNnQ
InChI InChI=1S/C13H19NO/c1-3-5-7-8-12-9-10-13(15)14(12)11-6-4-2/h3,5-8,11-12H,4,9-10H2,1-2H3/b5-3+,8-7+,11-6+/t12-/m1/s1
InChIKey IPGQQTQGTNUGBN-XLQPYENQSA-N
Mol Weight 205.3 g/mol
Molecular Formula C13H19NO
Exact Mass 205.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BlAV3tl4BDy
Name 4-(1',3'-Pentadienyl)-N-(1'-butenyl)-2-pyrrolidinone
Alternate Name(s) 1-[(1E)-1-butenyl]-4-[(1E,3E)-1,3-pentadienyl]-2-pyrrolidinone 5-(S)-(1',3'-Pentadienyl)-N-(1'-butenyl)-2-pyrrolidinone (5S)-1-[(E)-but-1-enyl]-5-[(1E,3E)-penta-1,3-dienyl]-2-pyrrolidinone (5S)-1-[(E)-but-1-enyl]-5-[(1E,3E)-penta-1,3-dienyl]pyrrolidin-2-one
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Formula C13H19NO
InChI InChI=1S/C13H19NO/c1-3-5-7-8-12-9-10-13(15)14(12)11-6-4-2/h3,5-8,11-12H,4,9-10H2,1-2H3/b5-3+,8-7+,11-6+/t12-/m1/s1
InChIKey IPGQQTQGTNUGBN-XLQPYENQSA-N
Molecular Weight 205.301 g/mol
SMILES C1(N([C@@](CC1)(\C=C\C=C\C)[H])\C=C\CC)=O
SPLASH splash10-05bf-9410000000-798c6d0ef5958b36e332
Source of Spectrum SK-22-2872-2
Wiley ID 852259