2-[4-(Isopropylsulfanyl)-2,6-dimethoxyphenyl]ethanamine

ChemSpider ID: 23553027
Molecular Formula: C₁₃H₂₁NO₂S
Average mass: 255.376297 Da
Monoisotopic mass: 255.129303 Da
Systematic name

2-[4-(Isopropylsulfanyl)-2,6-dimethoxyphenyl]ethanamine
SMILES and InChIs

SMILES:

CC(C)Sc1cc(c(c(c1)OC)CCN)OC Copied

Std. InChI:

InChI=1S/C13H21NO2S/c1-9(2)17-10-7-12(15-3)11(5-6-14)13(8-10)16-4/h7-9H,5-6,14H2,1-4H3 Copied

Std. InChIKey:

UMQKLDOKCOSGCS-UHFFFAOYSA-N Copied
Cite this record
CSID:23553027, http://www.chemspider.com/Chemical-Structure.23553027.html (accessed 11:20, May 23, 2013) Copied

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Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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