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1-(2-Bromoadamantan-1-yl)-N,N-dimethylmethanamine hydrochloride hydrate (2:2:1)

ChemSpider ID: 44397
Molecular Formula: C₂₆H₄₈Br₂Cl₂N₂O
Average mass: 635.386108 Da
Monoisotopic mass: 632.151001 Da
Systematic name

1-(2-Bromoadamantan-1-yl)-N,N-dimethylmethanamine hydrochloride hydrate (2:2:1)
SMILES and InChIs

SMILES:

Cl.Cl.BrC3C1CC2CC(C1)CC3(CN(C)C)C2.BrC3C1CC2CC3(CC(C1)C2)CN(C)C.O Copied

Std. InChI:

InChI=1S/2C13H22BrN.2ClH.H2O/c2*1-15(2)8-13-6-9-3-10(7-13)5-11(4-9)12(13)14;;;/h2*9-12H,3-8H2,1-2H3;2*1H;1H2 Copied

Std. InChIKey:

SDGBSUMWXQKCFN-UHFFFAOYSA-N Copied
Cite this record
CSID:44397, http://www.chemspider.com/Chemical-Structure.44397.html (accessed 19:05, May 23, 2013) Copied

Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts

1-Adamantanemethylamine, 2-bromo-N,N-dimethyl-, hydrochloride, hemihydrate

66969-02-6 [RN]

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

Click to predict properties on the Chemicalize site

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