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(5RS,6S)-5-sec-Butyl-3-[1-(4-hydroxyphenyl)amino]ethylidene-1H-pyrrolidine-2,4-dione
SpectraBase Compound ID 9cRQAJXpNIi
InChI InChI=1S/C16H20N2O3/c1-4-9(2)14-15(20)13(16(21)18-14)10(3)17-11-5-7-12(19)8-6-11/h5-9,14,17,19H,4H2,1-3H3,(H,18,21)/t9-,14?/m0/s1
InChIKey DKMZBCJNGWHFRV-CUVJYRNJSA-N
Mol Weight 288.35 g/mol
Molecular Formula C16H20N2O3
Exact Mass 288.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ENHY9XJ8qCF
Name (5RS,6S)-5-sec-Butyl-3-[1-(4-hydroxyphenyl)amino]ethylidene-1H-pyrrolidine-2,4-dione
Appearance Grey powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O3
InChI InChI=1S/C16H20N2O3/c1-4-9(2)14-15(20)13(16(21)18-14)10(3)17-11-5-7-12(19)8-6-11/h5-9,14,17,19H,4H2,1-3H3,(H,18,21)/t9-,14?/m0/s1
InChIKey DKMZBCJNGWHFRV-CUVJYRNJSA-N
Instrument Name GC/MS-QP2010
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.203
Molecular Weight 288.347 g/mol
Optical Rotation [a]D25 = +22.45 (c = 0.50, methanol)
SMILES N1C(C(C(=C(C)Nc2ccc(cc2)O)C1=O)=O)[C@@](C)(CC)[H]
SPLASH splash10-001i-0290000000-058b4a8f751415be1c2b
Source of Spectrum ARK-2010-43-5p
Wiley ID 1866783