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(5RS,6S)-5-sec-Butyl-3-[1-(4-methylphenyl)amino]ethylidene-1H-pyrrolidine-2,4-dione
SpectraBase Compound ID 5c5UJOWqk8C
InChI InChI=1S/C17H22N2O2/c1-5-11(3)15-16(20)14(17(21)19-15)12(4)18-13-8-6-10(2)7-9-13/h6-9,11,15,18H,5H2,1-4H3,(H,19,21)/t11-,15?/m0/s1
InChIKey JSLXDJOOUMUWPI-VPHXOMNUSA-N
Mol Weight 286.37 g/mol
Molecular Formula C17H22N2O2
Exact Mass 286.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtdkWSFxBBv
Name (5RS,6S)-5-sec-Butyl-3-[1-(4-methylphenyl)amino]ethylidene-1H-pyrrolidine-2,4-dione
Appearance White powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N2O2
InChI InChI=1S/C17H22N2O2/c1-5-11(3)15-16(20)14(17(21)19-15)12(4)18-13-8-6-10(2)7-9-13/h6-9,11,15,18H,5H2,1-4H3,(H,19,21)/t11-,15?/m0/s1
InChIKey JSLXDJOOUMUWPI-VPHXOMNUSA-N
Instrument Name GC/MS-QP2010
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.203
Molecular Weight 286.375 g/mol
Optical Rotation [a]D25 = +16.81 (c = 0.50, methanol)
SMILES N1C(C(C(=C(C)Nc2ccc(cc2)C)C1=O)=O)[C@@](C)(CC)[H]
SPLASH splash10-001i-1390000000-3e632deeb2f0d41edfe8
Source of Spectrum ARK-2010-42-5j
Wiley ID 1866777