CID 365603

Nsc633404

Structural Information

Molecular Formula
C21H24N4O
SMILES
CN(C)CCC(=O)N1CCC2=C(C1C3=CN=CC=C3)NC4=CC=CC=C24
InChI
InChI=1S/C21H24N4O/c1-24(2)12-10-19(26)25-13-9-17-16-7-3-4-8-18(16)23-20(17)21(25)15-6-5-11-22-14-15/h3-8,11,14,21,23H,9-10,12-13H2,1-2H3
InChIKey
YZJNMSAVSZFSRX-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-1-(1-pyridin-3-yl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.195 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.20228 184.4
[M+Na]+ 371.18422 197.9
[M+NH4]+ 366.22882 192.0
[M+K]+ 387.15816 191.9
[M-H]- 347.18772 188.3
[M+Na-2H]- 369.16967 190.7
[M]+ 348.19445 187.4
[M]- 348.19555 187.4
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.