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(5RS,6S)-5-sec-Butyl-3-[1-(2,4-dichlorophenyl)amino]ethylidene-1H-pyrrolidine-2,4-dione
SpectraBase Compound ID 6qoCN63pCd5
InChI InChI=1S/C16H18Cl2N2O2/c1-4-8(2)14-15(21)13(16(22)20-14)9(3)19-12-6-5-10(17)7-11(12)18/h5-8,14,19H,4H2,1-3H3,(H,20,22)/t8-,14?/m0/s1
InChIKey XTLPQPXCRKHZNC-BVVIDWAXSA-N
Mol Weight 341.24 g/mol
Molecular Formula C16H18Cl2N2O2
Exact Mass 340.074533 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWbs1Av56gu
Name (5RS,6S)-5-sec-Butyl-3-[1-(2,4-dichlorophenyl)amino]ethylidene-1H-pyrrolidine-2,4-dione
Appearance Colorless crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18Cl2N2O2
InChI InChI=1S/C16H18Cl2N2O2/c1-4-8(2)14-15(21)13(16(22)20-14)9(3)19-12-6-5-10(17)7-11(12)18/h5-8,14,19H,4H2,1-3H3,(H,20,22)/t8-,14?/m0/s1
InChIKey XTLPQPXCRKHZNC-BVVIDWAXSA-N
Instrument Name GC/MS-QP2010
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.203
Molecular Weight 341.238 g/mol
Optical Rotation [a]D25 = +21.37 (c = 0.50, methanol)
SMILES N1C(C(C(=C(C)Nc2ccc(cc2Cl)Cl)C1=O)=O)[C@@](C)(CC)[H]
SPLASH splash10-001i-0390000000-4afc7e7fe9e2eb5c1764
Source of Spectrum ARK-2010-44-5s
Wiley ID 1866786