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2-(methylthio)-4-phenylpenta-1,4-diene-1,1,5,5-tetracarbonitrile
SpectraBase Compound ID BlmTWAO1exp
InChI InChI=1S/C16H10N4S/c1-21-16(14(10-19)11-20)7-15(13(8-17)9-18)12-5-3-2-4-6-12/h2-6H,7H2,1H3
InChIKey VDTXZMKNFLWECL-UHFFFAOYSA-N
Mol Weight 290.34 g/mol
Molecular Formula C16H10N4S
Exact Mass 290.062618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2EPoirnkkbM
Name 2-(methylthio)-4-phenylpenta-1,4-diene-1,1,5,5-tetracarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10N4S
InChI InChI=1S/C16H10N4S/c1-21-16(14(10-19)11-20)7-15(13(8-17)9-18)12-5-3-2-4-6-12/h2-6H,7H2,1H3
InChIKey VDTXZMKNFLWECL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19813230317
Molecular Weight 290.344 g/mol
SMILES C(C#N)(=C(CC(SC)=C(C#N)C#N)c1ccccc1)C#N
SPLASH splash10-0006-1090000000-37a3676082d1ff5ab933
Source of Spectrum JF-323-503-4a
Wiley ID 1791296