CID 504339

N,n-diethyl-3-(1-methylpyrido[3,4-b]indol-9-yl)propan-1-amine

Structural Information

Molecular Formula
C19H25N3
SMILES
CCN(CC)CCCN1C2=CC=CC=C2C3=C1C(=NC=C3)C
InChI
InChI=1S/C19H25N3/c1-4-21(5-2)13-8-14-22-18-10-7-6-9-16(18)17-11-12-20-15(3)19(17)22/h6-7,9-12H,4-5,8,13-14H2,1-3H3
InChIKey
IEOKEWICYGFNEF-UHFFFAOYSA-N
Compound name
N,N-diethyl-3-(1-methylpyrido[3,4-b]indol-9-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.20483 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.21211 173.8
[M+Na]+ 318.19405 182.6
[M-H]- 294.19755 178.0
[M+NH4]+ 313.23865 191.3
[M+K]+ 334.16799 177.6
[M+H-H2O]+ 278.20209 164.7
[M+HCOO]- 340.20303 195.7
[M+CH3COO]- 354.21868 212.9
[M+Na-2H]- 316.17950 178.5
[M]+ 295.20428 179.6
[M]- 295.20538 179.6
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.