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3-amidino-7,10-dimethyl-3-azatricyclo[3.3.3.0(1,5)]undecane hydrochloride
SpectraBase Compound ID 5dtlBHMskvR
InChI InChI=1S/C13H23N3.ClH/c1-9-3-12-5-10(2)6-13(12,4-9)8-16(7-12)11(14)15;/h9-10H,3-8H2,1-2H3,(H3,14,15);1H/t9-,10?,12-,13+;
InChIKey PHGLWPXFUJPESL-XWTQUXFASA-N
Mol Weight 257.81 g/mol
Molecular Formula C13H24ClN3
Exact Mass 257.165875 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID NeJw3ydc0i
Name 3-amidino-7,10-dimethyl-3-azatricyclo[3.3.3.0(1,5)]undecane hydrochloride
Appearance White solid
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Formula C13H24ClN3
InChI InChI=1S/C13H23N3.ClH/c1-9-3-12-5-10(2)6-13(12,4-9)8-16(7-12)11(14)15;/h9-10H,3-8H2,1-2H3,(H3,14,15);1H/t9-,10?,12-,13+;
InChIKey PHGLWPXFUJPESL-XWTQUXFASA-N
Instrument Name Hewlett-Packard 5988A
Ionization Type EI
Literature Reference DOI 10.1021/ml500108s
Molecular Weight 257.809 g/mol
SMILES Cl.N=C(N1C[C@]23[C@@](CC(C3)C)(C[C@](C2)(C)[H])C1)N
SPLASH splash10-05g0-8590000000-81fb1d0a6815fc0ca4e5
Source of Spectrum MCS-5-SM21-26.HCl
Wiley ID 1864205