CID 135618177

4-azatricyclo(4.3.1.1(sup 3,8))undec-4-ene, 5-(2-(dimethylamino)ethylamino)-, dihydrochloride

Structural Information

Molecular Formula
C14H25N3
SMILES
CN(C)CCN=C1C2CC3CC(C2)CC(C3)N1
InChI
InChI=1S/C14H25N3/c1-17(2)4-3-15-14-12-6-10-5-11(7-12)9-13(8-10)16-14/h10-13H,3-9H2,1-2H3,(H,15,16)
InChIKey
IDZPJHWVKFQCDL-UHFFFAOYSA-N
Compound name
2-(4-azatricyclo[4.3.1.13,8]undecan-5-ylideneamino)-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.20485 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.21213 164.2
[M+Na]+ 258.19407 169.8
[M-H]- 234.19757 164.8
[M+NH4]+ 253.23867 184.0
[M+K]+ 274.16801 166.2
[M+H-H2O]+ 218.20211 163.1
[M+HCOO]- 280.20305 173.4
[M+CH3COO]- 294.21870 172.1
[M+Na-2H]- 256.17952 172.6
[M]+ 235.20430 162.3
[M]- 235.20540 162.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.