CID 114141

In 205

Structural Information

Molecular Formula
C18H24N3
SMILES
CC1=C2C(=C3C=CC=CC3=N2)C=CN1CCC[N+](C)(C)C
InChI
InChI=1S/C18H24N3/c1-14-18-16(15-8-5-6-9-17(15)19-18)10-12-20(14)11-7-13-21(2,3)4/h5-6,8-10,12H,7,11,13H2,1-4H3/q+1
InChIKey
XMZJPAUMSDMAHG-UHFFFAOYSA-N
Compound name
trimethyl-[3-(1-methylpyrido[3,4-b]indol-2-yl)propyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.19702 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.204296 169.2
[M+Na]+ 305.186238 178.8
[M-H]- 281.189744 174.0
[M+NH4]+ 300.230843 187.4
[M+K]+ 321.160178 168.4
[M+H-H2O]+ 265.194280 163.7
[M+HCOO]- 327.195221 190.2
[M+CH3COO]- 341.210871 203.0
[M+Na-2H]- 303.171686 178.9
[M]+ 282.19647142 173.0
[M]- 282.19756858 173.0
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.