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Isothiourea, 1-(2,6-dichlorophenyl)-3-(3-methoxypropyl)-2-methyl-
SpectraBase Compound ID CjeOyUxoYjl
InChI InChI=1S/C12H16Cl2N2OS/c1-17-8-4-7-15-12(18-2)16-11-9(13)5-3-6-10(11)14/h3,5-6H,4,7-8H2,1-2H3,(H,15,16)
InChIKey XHMVPBXKGZWKIK-UHFFFAOYSA-N
Mol Weight 307.24 g/mol
Molecular Formula C12H16Cl2N2OS
Exact Mass 306.03604 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FtFE9dNEHt8
Name Isothiourea, 1-(2,6-dichlorophenyl)-3-(3-methoxypropyl)-2-methyl-
Alternate Name(s) 1-(2,6-dichlorophenyl)-3-(3-methoxypropyl)-2-methyl-isothiourea Methyl N-(2,6-dichlorophenyl)-N'-(3-methoxypropyl)carbamimidothioate Methyl N-(2,6-dichlorophenyl)-N'-[(Z)-3-methoxypropyl]imidothiocarbamate Methyl N-[2,6-bis(chloranyl)phenyl]-N'-(3-methoxypropyl)carbamimidothioate N-(2,6-dichlorophenyl)-N'-(3-methoxypropyl)carbamimidothioic acid methyl ester
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Formula C12H16Cl2N2OS
InChI InChI=1S/C12H16Cl2N2OS/c1-17-8-4-7-15-12(18-2)16-11-9(13)5-3-6-10(11)14/h3,5-6H,4,7-8H2,1-2H3,(H,15,16)
InChIKey XHMVPBXKGZWKIK-UHFFFAOYSA-N
Molecular Weight 307.239 g/mol
SMILES N(\C(=N\CCCOC)SC)c1c(Cl)cccc1Cl
SPLASH splash10-0005-9560000000-65314d450f72f7ce4ba3
Source of Spectrum AD-0-2532-0
Wiley ID 1428721