CID 110928

4,7-methanoindan, hexahydro-1,8-diamino-

Structural Information

Molecular Formula

C₁₀H₁₈N₂

SMILES

C1CC2C3C(C1C2N)CCC3N

InChI

InChI=1S/C10H18N2/c11-8-4-3-5-6-1-2-7(9(5)8)10(6)12/h5-10H,1-4,11-12H2

InChIKey

LKNAADOFXVIZGJ-UHFFFAOYSA-N

Compound name

tricyclo[5.2.1.02,6]decane-3,10-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 166.147 Da
Monoisotopic Mass: 0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	167.154276	137.7
[M+Na]+	189.136218	144.3
[M-H]-	165.139724	140.8
[M+NH4]+	184.180823	165.3
[M+K]+	205.110158	141.3
[M+H-H2O]+	149.144260	134.0
[M+HCOO]-	211.145201	158.4
[M+CH3COO]-	225.160851	150.6
[M+Na-2H]-	187.121666	138.1
[M]+	166.14645142	131.9
[M]-	166.14754858	131.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.