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Propanedinitrile, [1-[[(4-methylphenyl)sulfonyl]methyl]nonylidene]-
SpectraBase Compound ID 9p7AVdftGAI
InChI InChI=1S/C20H26N2O2S/c1-3-4-5-6-7-8-9-18(19(14-21)15-22)16-25(23,24)20-12-10-17(2)11-13-20/h10-13H,3-9,16H2,1-2H3
InChIKey KTDRXAVZSNCOQA-UHFFFAOYSA-N
Mol Weight 358.5 g/mol
Molecular Formula C20H26N2O2S
Exact Mass 358.171499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6gHEhf2wIZf
Name Propanedinitrile, [1-[[(4-methylphenyl)sulfonyl]methyl]nonylidene]-
CAS Registry Number 108895-61-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26N2O2S
InChI InChI=1S/C20H26N2O2S/c1-3-4-5-6-7-8-9-18(19(14-21)15-22)16-25(23,24)20-12-10-17(2)11-13-20/h10-13H,3-9,16H2,1-2H3
InChIKey KTDRXAVZSNCOQA-UHFFFAOYSA-N
Molecular Weight 358.500 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)C(=C(C#N)C#N)CCCCCCCC
SPLASH splash10-0a4l-8900000000-04c45197e4e21b1dc368
Source of Spectrum J-52-4268-8
Synonyms 2-(1-{[(4-Methylphenyl)sulfonyl]methyl}nonylidene)malononitrile
Wiley ID 1347093