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Isothiourea, 1-(3,4-dichlorophenyl)-2-methyl-3-(1,1-dimethyl-2-propynyl)-
SpectraBase Compound ID 7qR3Q22R0Mu
InChI InChI=1S/C13H14Cl2N2S/c1-5-13(2,3)17-12(18-4)16-9-6-7-10(14)11(15)8-9/h1,6-8H,2-4H3,(H,16,17)
InChIKey FVOWWYCJKLPTDG-UHFFFAOYSA-N
Mol Weight 301.24 g/mol
Molecular Formula C13H14Cl2N2S
Exact Mass 300.025475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8yHHxYBGeUC
Name Isothiourea, 1-(3,4-dichlorophenyl)-2-methyl-3-(1,1-dimethyl-2-propynyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14Cl2N2S
InChI InChI=1S/C13H14Cl2N2S/c1-5-13(2,3)17-12(18-4)16-9-6-7-10(14)11(15)8-9/h1,6-8H,2-4H3,(H,16,17)
InChIKey FVOWWYCJKLPTDG-UHFFFAOYSA-N
Molecular Weight 301.235 g/mol
SMILES N(\C(=N/C(C#C)(C)C)SC)c1cc(Cl)c(cc1)Cl
SPLASH splash10-000i-5390000000-fdb264a28617063e54a1
Source of Spectrum AD-0-2532-0
Synonyms 1-(3,4-dichlorophenyl)-3-(1,1-dimethylprop-2-ynyl)-2-methyl-isothiourea Methyl N-(3,4-dichlorophenyl)-N'-(2-methylbut-3-yn-2-yl)carbamimidothioate Methyl N-(3,4-dichlorophenyl)-N'-[(E)-1,1-dimethyl-2-propynyl]imidothiocarbamate N-(3,4-dichlorophenyl)-N'-(2-methylbut-3-yn-2-yl)carbamimidothioic acid methyl ester
Wiley ID 1428966