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4,6,10,12-Tetraazahexacyclo[13.2.1.0(7,17).0(9,16)]octadecane
SpectraBase Compound ID KJlPKABhcHG
InChI InChI=1S/C14H22N4O2/c19-11-1-3-15-7-5-10-14-8(6-9(17-11)13(7)14)16-4-2-12(20)18-10/h7-10,13-16H,1-6H2,(H,17,19)(H,18,20)/t7-,8+,9-,10-,13+,14-/m0/s1
InChIKey NPIHPOYIUWNBGI-JLLJEVNVSA-N
Mol Weight 278.36 g/mol
Molecular Formula C14H22N4O2
Exact Mass 278.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XyJaQZH0hG
Name 4,6,10,12-Tetraazahexacyclo[13.2.1.0(7,17).0(9,16)]octadecane
Comments Less than 3 mono-isotopic peaks
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Formula C14H22N4O2
InChI InChI=1S/C14H22N4O2/c19-11-1-3-15-7-5-10-14-8(6-9(17-11)13(7)14)16-4-2-12(20)18-10/h7-10,13-16H,1-6H2,(H,17,19)(H,18,20)/t7-,8+,9-,10-,13+,14-/m0/s1
InChIKey NPIHPOYIUWNBGI-JLLJEVNVSA-N
Molecular Weight 278.356 g/mol
SMILES N1C(CCN[C@]2([C@@]3([C@]4([C@@](NC(CCN[C@]4(C[C@]13[H])[H])=O)(C2)[H])[H])[H])[H])=O
SPLASH splash10-004i-0090000000-65f68ab78e8939b756f7
Source of Spectrum H-2005-1327-46
Wiley ID 1562483