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1-Chloro-4-(1,2-dithiocyanatoethyl)benzene
SpectraBase Compound ID CljiFFN0Vo3
InChI InChI=1S/C10H7ClN2S2/c11-9-3-1-8(2-4-9)10(15-7-13)5-14-6-12/h1-4,10H,5H2
InChIKey YELYRVIIAFGVBI-UHFFFAOYSA-N
Mol Weight 254.75 g/mol
Molecular Formula C10H7ClN2S2
Exact Mass 253.973918 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WYlnTcmOK1
Name 1-Chloro-4-(1,2-dithiocyanatoethyl)benzene
Alternate Name(s) 1-(4-Chlorophenyl)-2-(cyanosulfanyl)ethyl thiocyanate thiocyanic acid[1-(4-chlorophenyl)-2-thiocyanato-ethyl]ester [1-(4-chlorophenyl)-2-thiocyanato-ethyl]thiocyanate thiocyanic acid [1-(4-chlorophenyl)-2-thiocyanatoethyl] ester [1-(4-chlorophenyl)-2-thiocyanatoethyl] thiocyanate [1-(4-chlorophenyl)-2-thiocyanato-ethyl] thiocyanate
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Formula C10H7ClN2S2
InChI InChI=1S/C10H7ClN2S2/c11-9-3-1-8(2-4-9)10(15-7-13)5-14-6-12/h1-4,10H,5H2
InChIKey YELYRVIIAFGVBI-UHFFFAOYSA-N
Molecular Weight 254.753 g/mol
SMILES c1(ccc(cc1)C(CSC#N)SC#N)Cl
SPLASH splash10-0f9l-6900000000-f8df80bf16be85608104
Source of Spectrum C5-2004-1985-3
Wiley ID 1617126