CID 30217

2,3,4,5-tetrahydro-2-methyl-5-(2-(6-methyl-3-pyridyl)ethyl)-1h-pyrido(4,3-b)indole

Structural Information

Molecular Formula
C20H23N3
SMILES
CC1CC2=C(CN1)C3=C(C=CC=C3N2)CCC4=CN=C(C=C4)C
InChI
InChI=1S/C20H23N3/c1-13-6-7-15(11-21-13)8-9-16-4-3-5-18-20(16)17-12-22-14(2)10-19(17)23-18/h3-7,11,14,22-23H,8-10,12H2,1-2H3
InChIKey
CBHKORLHJIYAKT-UHFFFAOYSA-N
Compound name
3-methyl-9-[2-(6-methylpyridin-3-yl)ethyl]-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.1892 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.19648 176.0
[M+Na]+ 328.17842 184.5
[M-H]- 304.18192 177.9
[M+NH4]+ 323.22302 189.6
[M+K]+ 344.15236 175.7
[M+H-H2O]+ 288.18646 166.4
[M+HCOO]- 350.18740 190.1
[M+CH3COO]- 364.20305 185.2
[M+Na-2H]- 326.16387 178.8
[M]+ 305.18865 173.4
[M]- 305.18975 173.4
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.