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(5RS,6S)-5-sec-Butyl-3-(1-cyclohexylamino)ethylidene-1H-pyrrolidine-2,4-dione
SpectraBase Compound ID KEBbUpF9ZCD
InChI InChI=1S/C16H26N2O2/c1-4-10(2)14-15(19)13(16(20)18-14)11(3)17-12-8-6-5-7-9-12/h10,12,14,17H,4-9H2,1-3H3,(H,18,20)/t10-,14?/m0/s1
InChIKey KIEMKTWWASZDFQ-XLLULAGJSA-N
Mol Weight 278.4 g/mol
Molecular Formula C16H26N2O2
Exact Mass 278.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZ0sxODaEBC
Name (5RS,6S)-5-sec-Butyl-3-(1-cyclohexylamino)ethylidene-1H-pyrrolidine-2,4-dione
Appearance White powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26N2O2
InChI InChI=1S/C16H26N2O2/c1-4-10(2)14-15(19)13(16(20)18-14)11(3)17-12-8-6-5-7-9-12/h10,12,14,17H,4-9H2,1-3H3,(H,18,20)/t10-,14?/m0/s1
InChIKey KIEMKTWWASZDFQ-XLLULAGJSA-N
Instrument Name GC/MS-QP2010
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.203
Molecular Weight 278.396 g/mol
Optical Rotation [a]D25 = +9.40 (c = 0.50, methanol)
SMILES N1C(C(C(=C(C)NC2CCCCC2)C1=O)=O)[C@@](C)(CC)[H]
SPLASH splash10-00di-2290000000-eb260a6a0f8a86c360da
Source of Spectrum ARK-2010-41-5g
Wiley ID 1866774