CID 3071285

87603-19-8

Structural Information

Molecular Formula
C18H23N3O3
SMILES
CC(C)NCC(COC1=C2C3=C(C=CC(=C3)OC)NC2=CN=C1)O
InChI
InChI=1S/C18H23N3O3/c1-11(2)20-7-12(22)10-24-17-9-19-8-16-18(17)14-6-13(23-3)4-5-15(14)21-16/h4-6,8-9,11-12,20-22H,7,10H2,1-3H3
InChIKey
WSSGZJKVKADLCK-UHFFFAOYSA-N
Compound name
1-[(6-methoxy-9H-pyrido[3,4-b]indol-4-yl)oxy]-3-(propan-2-ylamino)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.17395 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.18123 178.2
[M+Na]+ 352.16317 189.2
[M+NH4]+ 347.20777 184.3
[M+K]+ 368.13711 185.4
[M-H]- 328.16667 178.7
[M+Na-2H]- 350.14862 181.3
[M]+ 329.17340 179.6
[M]- 329.17450 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.