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3-Cyano-1-methyl-4-(4-dimethylaminophenyl)-2,5-dihydro-5-oxopyrrole-2-thione
SpectraBase Compound ID 3WhLApB5b0r
InChI InChI=1S/C14H13N3OS/c1-16(2)10-6-4-9(5-7-10)12-11(8-15)14(19)17(3)13(12)18/h4-7H,1-3H3
InChIKey GLMRVAADDLVUSO-UHFFFAOYSA-N
Mol Weight 271.34 g/mol
Molecular Formula C14H13N3OS
Exact Mass 271.077933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7cBGTVkJ008
Name 3-Cyano-1-methyl-4-(4-dimethylaminophenyl)-2,5-dihydro-5-oxopyrrole-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13N3OS
InChI InChI=1S/C14H13N3OS/c1-16(2)10-6-4-9(5-7-10)12-11(8-15)14(19)17(3)13(12)18/h4-7H,1-3H3
InChIKey GLMRVAADDLVUSO-UHFFFAOYSA-N
Molecular Weight 271.338 g/mol
SMILES C=1(C(N(C)C(C1c1ccc(cc1)N(C)C)=O)=S)C#N
SPLASH splash10-00di-0090000000-712e3c76b6ceba135adc
Source of Spectrum H1-46-44-5
Synonyms 4-[4-(dimethylamino)phenyl]-1-methyl-5-oxo-2-thioxo-2,5-dihydro-1H-pyrrole-3-carbonitrile
Wiley ID 816054