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5-Phenyl-6-(.alpha.-oxopyrrolidinocarbonyl)bicyclo-(2.2.1)hept-2-ene

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5-Phenyl-6-(.alpha.-oxopyrrolidinocarbonyl)bicyclo-(2.2.1)hept-2-ene
SpectraBase Compound ID KktXM8zeaqk
InChI InChI=1S/C18H19NO2/c20-15-7-4-10-19(15)18(21)17-14-9-8-13(11-14)16(17)12-5-2-1-3-6-12/h1-3,5-6,8-9,13-14,16-17H,4,7,10-11H2/t13-,14+,16-,17-/m1/s1
InChIKey ZDQUOBMGULDRHI-YALNPMBYSA-N
Mol Weight 281.35 g/mol
Molecular Formula C18H19NO2
Exact Mass 281.141579 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9WPqT6Tq6Yg
Name 5-Phenyl-6-(.alpha.-oxopyrrolidinocarbonyl)bicyclo-(2.2.1)hept-2-ene
Comments Computed using HOSE algorithm
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Exact Mass 281.141578854 u
Formula C18H19NO2
InChI InChI=1S/C18H19NO2/c20-15-7-4-10-19(15)18(21)17-14-9-8-13(11-14)16(17)12-5-2-1-3-6-12/h1-3,5-6,8-9,13-14,16-17H,4,7,10-11H2/t13-,14+,16-,17-/m1/s1
InChIKey ZDQUOBMGULDRHI-YALNPMBYSA-N
Molecular Weight 281.355 g/mol
SMILES C1=C[C@]2(C[C@@]1([C@]([C@@]2(C(=O)N1C(CCC1)=O)[H])(C1=CC=CC=C1)[H])[H])[H]