CID 215228

2,3,4,9-tetrahydro-9-methyl-1-(2-piperidinyl)-1h-pyrido(3,4-b)indole

Structural Information

Molecular Formula
C17H23N3
SMILES
CN1C2=CC=CC=C2C3=C1C(NCC3)C4CCCCN4
InChI
InChI=1S/C17H23N3/c1-20-15-8-3-2-6-12(15)13-9-11-19-16(17(13)20)14-7-4-5-10-18-14/h2-3,6,8,14,16,18-19H,4-5,7,9-11H2,1H3
InChIKey
MRXYYVKVCQMHRA-UHFFFAOYSA-N
Compound name
9-methyl-1-piperidin-2-yl-1,2,3,4-tetrahydropyrido[3,4-b]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.1892 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.19648 165.5
[M+Na]+ 292.17842 171.4
[M-H]- 268.18192 166.3
[M+NH4]+ 287.22302 180.0
[M+K]+ 308.15236 163.8
[M+H-H2O]+ 252.18646 156.0
[M+HCOO]- 314.18740 176.3
[M+CH3COO]- 328.20305 174.0
[M+Na-2H]- 290.16387 167.5
[M]+ 269.18865 157.2
[M]- 269.18975 157.2
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.