Vitas-M small molecule compound
1-(1-isothiocyanatoethyl)tricyclo[3.3.1.1~3,7~]decane
Catalog ID
STK164677
SMILES CC(C12CC3CC(C2)CC(C1)C3)N=C=S
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H19NS MW 221.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19NS/c1-9(14-8-15)13-5-10-2-11(6-13)4-12(3-10)7-13/h9-12H,2-7H2,1H3InChIKey
NPQQRDNZDAFARW-UHFFFAOYSA-NSynonyms
1(1ISOTHIOCYANATOETHYL)ADAMANTANE
1(1isothiocyanatoethyl)tricyclo(3311~37~)decane
CC(C12CC3CC(C1)CC(C3)C2)N=C=S
InChI=1SC13H19NSc19(14815)13510211(613)412(310)713h912H27H21H3
MFCD03759901
ZINC000004702278
ZINC000004702279
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