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2-(4,4-Dimethyl-5-oxo-2-thioxoimidazolidin-1-yl)benzonitrile
SpectraBase Compound ID F90z1kRF1Iw
InChI InChI=1S/C12H11N3OS/c1-12(2)10(16)15(11(17)14-12)9-6-4-3-5-8(9)7-13/h3-6H,1-2H3,(H,14,17)
InChIKey ZGDSVFZPEVSHCR-UHFFFAOYSA-N
Mol Weight 245.3 g/mol
Molecular Formula C12H11N3OS
Exact Mass 245.062283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6pj17vJ5ib7
Name 2-(4,4-Dimethyl-5-oxo-2-thioxoimidazolidin-1-yl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N3OS
InChI InChI=1S/C12H11N3OS/c1-12(2)10(16)15(11(17)14-12)9-6-4-3-5-8(9)7-13/h3-6H,1-2H3,(H,14,17)
InChIKey ZGDSVFZPEVSHCR-UHFFFAOYSA-N
Molecular Weight 245.300 g/mol
SMILES N1C(C(N(C1=S)c1c(C#N)cccc1)=O)(C)C
SPLASH splash10-03dj-0950000000-a9b91c042cc5f24c22c5
Source of Spectrum F-62-7659-5
Synonyms 2-(4,4-dimethyl-5-oxo-2-thioxo-1-imidazolidinyl)benzonitrile
Wiley ID 1640228