CID 365598

Nsc633399

Structural Information

Molecular Formula
C20H24N4
SMILES
CN(C)CCN1CCC2=C(C1C3=CN=CC=C3)NC4=CC=CC=C24
InChI
InChI=1S/C20H24N4/c1-23(2)12-13-24-11-9-17-16-7-3-4-8-18(16)22-19(17)20(24)15-6-5-10-21-14-15/h3-8,10,14,20,22H,9,11-13H2,1-2H3
InChIKey
HPWNAQYMZWECFY-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(1-pyridin-3-yl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.2001 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.20738 177.8
[M+Na]+ 343.18932 184.9
[M-H]- 319.19282 181.9
[M+NH4]+ 338.23392 191.4
[M+K]+ 359.16326 178.2
[M+H-H2O]+ 303.19736 167.1
[M+HCOO]- 365.19830 194.9
[M+CH3COO]- 379.21395 187.3
[M+Na-2H]- 341.17477 181.9
[M]+ 320.19955 177.1
[M]- 320.20065 177.1
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.