CID 218507

2,3,4,9-tetrahydro-3,9-dimethyl-6-methoxy-1-(2-pyridinyl)-1h-pyrido(3,4-b)indole hcl

Structural Information

Molecular Formula
C19H21N3O
SMILES
CC1CC2=C(C(N1)C3=CC=CC=N3)N(C4=C2C=C(C=C4)OC)C
InChI
InChI=1S/C19H21N3O/c1-12-10-15-14-11-13(23-3)7-8-17(14)22(2)19(15)18(21-12)16-6-4-5-9-20-16/h4-9,11-12,18,21H,10H2,1-3H3
InChIKey
AILVWJFOOGQGSA-UHFFFAOYSA-N
Compound name
6-methoxy-3,9-dimethyl-1-pyridin-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

307.16846 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.17574 175.7
[M+Na]+ 330.15768 185.8
[M-H]- 306.16118 179.4
[M+NH4]+ 325.20228 190.0
[M+K]+ 346.13162 178.6
[M+H-H2O]+ 290.16572 165.9
[M+HCOO]- 352.16666 191.7
[M+CH3COO]- 366.18231 186.1
[M+Na-2H]- 328.14313 178.6
[M]+ 307.16791 176.2
[M]- 307.16901 176.2
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.