CID 59533

102571-41-5

Structural Information

Molecular Formula
C17H24N3
SMILES
C[N+](C)(C)CCN(CC1=CC=CC=C1)C2=CC=CC=N2
InChI
InChI=1S/C17H24N3/c1-20(2,3)14-13-19(17-11-7-8-12-18-17)15-16-9-5-4-6-10-16/h4-12H,13-15H2,1-3H3/q+1
InChIKey
UDNMSFMBZBZAOB-UHFFFAOYSA-N
Compound name
2-[benzyl(pyridin-2-yl)amino]ethyl-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.19702 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.20430 164.3
[M+Na]+ 293.18624 168.6
[M-H]- 269.18974 171.7
[M+NH4]+ 288.23084 179.5
[M+K]+ 309.16018 160.6
[M+H-H2O]+ 253.19428 157.6
[M+HCOO]- 315.19522 188.3
[M+CH3COO]- 329.21087 203.3
[M+Na-2H]- 291.17169 174.4
[M]+ 270.19647 164.4
[M]- 270.19757 164.4
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.