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1-(1,2-Dithiocyanatoethyl)-4-methylbenzene
SpectraBase Compound ID 5QwFMwM8BNf
InChI InChI=1S/C11H10N2S2/c1-9-2-4-10(5-3-9)11(15-8-13)6-14-7-12/h2-5,11H,6H2,1H3
InChIKey KOXCYKJGLLDTJU-UHFFFAOYSA-N
Mol Weight 234.33 g/mol
Molecular Formula C11H10N2S2
Exact Mass 234.028541 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2dByTfoQOvo
Name 1-(1,2-Dithiocyanatoethyl)-4-methylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10N2S2
InChI InChI=1S/C11H10N2S2/c1-9-2-4-10(5-3-9)11(15-8-13)6-14-7-12/h2-5,11H,6H2,1H3
InChIKey KOXCYKJGLLDTJU-UHFFFAOYSA-N
Molecular Weight 234.335 g/mol
SMILES c1(ccc(cc1)C)C(CSC#N)SC#N
SPLASH splash10-016u-5910000000-a51e933e86cf613e39e7
Source of Spectrum C5-2004-1985-3
Synonyms 2-(cyanosulfanyl)-1-(4-methylphenyl)ethyl thiocyanate thiocyanic acid[1-(4-methylphenyl)-2-thiocyanatoethyl]ester thiocyanic acid[1-(p-tolyl)-2-thiocyanato-ethyl]ester [1-(4-methylphenyl)-2-thiocyanato-ethyl]thiocyanate [1-(p-tolyl)-2-thiocyanato-ethyl]thiocyanate thiocyanic acid [1-(4-methylphenyl)-2-thiocyanatoethyl] ester [1-(4-methylphenyl)-2-thiocyanatoethyl] thiocyanate [1-(p-tolyl)-2-thiocyanato-ethyl] thiocyanate [1-(4-methylphenyl)-2-thiocyanato-ethyl] thiocyanate
Wiley ID 1617124