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(S)-1-Benzyl-3-(N-methoxycarbonyl)amino-2-pyrrolidinone
SpectraBase Compound ID 3RWufvbVTi8
InChI InChI=1S/C13H16N2O3/c1-18-13(17)14-11-7-8-15(12(11)16)9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,14,17)/t11-/m0/s1
InChIKey HHOGFRQYBHLOOU-NSHDSACASA-N
Mol Weight 248.28 g/mol
Molecular Formula C13H16N2O3
Exact Mass 248.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8KsfisHDsZJ
Name (S)-1-Benzyl-3-(N-methoxycarbonyl)amino-2-pyrrolidinone
Appearance White solid
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Formula C13H16N2O3
InChI InChI=1S/C13H16N2O3/c1-18-13(17)14-11-7-8-15(12(11)16)9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,14,17)/t11-/m0/s1
InChIKey HHOGFRQYBHLOOU-NSHDSACASA-N
Ionization Type EI
Molecular Weight 248.282 g/mol
Optical Rotation [a]D = -7.96 (c = 0.33, CHCl3)
Reported Formula C13H16N2O3
SMILES N([C@]1(CCN(C1=O)Cc1ccccc1)[H])C(=O)OC
SPLASH splash10-006x-9430000000-73be5017720bfeca492e
Source of Spectrum WO2014125145A1
Wiley ID 1850059