CID 24844834

9h-pyrido(3,4-b)indole, 1,3-dimethyl-9-(2-(dimethylamino)ethyl)-, dihydrochloride

Structural Information

Molecular Formula
C17H21N3
SMILES
CC1=CC2=C(C(=N1)C)N(C3=CC=CC=C32)CCN(C)C
InChI
InChI=1S/C17H21N3/c1-12-11-15-14-7-5-6-8-16(14)20(10-9-19(3)4)17(15)13(2)18-12/h5-8,11H,9-10H2,1-4H3
InChIKey
QPFXJAJDRLQYON-UHFFFAOYSA-N
Compound name
2-(1,3-dimethylpyrido[3,4-b]indol-9-yl)-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

267.17355 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.18083 163.4
[M+Na]+ 290.16277 178.6
[M+NH4]+ 285.20737 172.8
[M+K]+ 306.13671 171.8
[M-H]- 266.16627 167.3
[M+Na-2H]- 288.14822 170.1
[M]+ 267.17300 166.8
[M]- 267.17410 166.8
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

patents stripe