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(3S)-1-methyl-3-(2-oxocyclohexyl)pyrrolidine-2,5-dione
SpectraBase Compound ID JMFIhTLYSs6
InChI InChI=1S/C11H15NO3/c1-12-10(14)6-8(11(12)15)7-4-2-3-5-9(7)13/h7-8H,2-6H2,1H3/t7?,8-/m0/s1
InChIKey SIQKVIZLKPPCQF-MQWKRIRWSA-N
Mol Weight 209.24 g/mol
Molecular Formula C11H15NO3
Exact Mass 209.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LN4c9WxcmEA
Name (3S)-1-methyl-3-(2-oxocyclohexyl)pyrrolidine-2,5-dione
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NO3
InChI InChI=1S/C11H15NO3/c1-12-10(14)6-8(11(12)15)7-4-2-3-5-9(7)13/h7-8H,2-6H2,1H3/t7?,8-/m0/s1
InChIKey SIQKVIZLKPPCQF-MQWKRIRWSA-N
Instrument Name Agilent 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202000335
Molecular Weight 209.245 g/mol
SMILES C1(=O)[C@](C2CCCCC2=O)(CC(=O)N1C)[H]
SPLASH splash10-03dj-9500000000-c0dd6040e2d6d6a3144c
Sample Comments diastereomer mixture of syn/anti (80:20)
Source of Spectrum ASC-362-SM72-18cd
Wiley ID 1855515