CID 3041510

9h-pyrido(3,4-b)indol-1(2h)-one, 3,4-dihydro-9-(2-(dimethylamino)ethyl)-7-methoxy-

Structural Information

Molecular Formula
C16H21N3O2
SMILES
CN(C)CCN1C2=C(C=CC(=C2)OC)C3=C1C(=O)NCC3
InChI
InChI=1S/C16H21N3O2/c1-18(2)8-9-19-14-10-11(21-3)4-5-12(14)13-6-7-17-16(20)15(13)19/h4-5,10H,6-9H2,1-3H3,(H,17,20)
InChIKey
FXFLDFZLEDUGPP-UHFFFAOYSA-N
Compound name
9-[2-(dimethylamino)ethyl]-7-methoxy-3,4-dihydro-2H-pyrido[3,4-b]indol-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.1634 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.17068 167.1
[M+Na]+ 310.15262 179.1
[M+NH4]+ 305.19722 174.7
[M+K]+ 326.12656 174.3
[M-H]- 286.15612 168.8
[M+Na-2H]- 308.13807 170.6
[M]+ 287.16285 169.1
[M]- 287.16395 169.1
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.