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1-Isothiocyanato-7-(methylthio)heptane

Properties

Image

Occurences in reactions

MNX_ID

MNXM115966

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₉H₁₇NS₂

charge

mass

203.08024

reference

InChIKey

LDIRGNDMTOGVRB-UHFFFAOYSA-N

InChI

InChI=1S/C9H17NS2/c1-12-8-6-4-2-3-5-7-10-9-11/h2-8H2,1H3

SMILES

CSCCCCCCCN=C=S

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0038440	1-Isothiocyanato-7-(methylthio)heptane 1-Isothiocyanato-7-(methylsulphanyl)heptane 1-isothiocyanato-7-(methylsulfanyl)heptane 7-(Methylthio)heptyl isothiocyanate
hmdb:HMDB38440	secondary/obsolete/fantasy identifier