CID 149479

72238-04-1

Structural Information

Molecular Formula
C23H28N4O
SMILES
CCN(CC)CCCNC1=NC=CC2=C(C3=C(C=C21)C4=C(N3)C=CC(=C4)O)C
InChI
InChI=1S/C23H28N4O/c1-4-27(5-2)12-6-10-24-23-20-14-19-18-13-16(28)7-8-21(18)26-22(19)15(3)17(20)9-11-25-23/h7-9,11,13-14,26,28H,4-6,10,12H2,1-3H3,(H,24,25)
InChIKey
JOTXWZGCPJPKOO-UHFFFAOYSA-N
Compound name
1-[3-(diethylamino)propylamino]-5-methyl-6H-pyrido[4,3-b]carbazol-9-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

11
Patents

376.22632 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 377.23360 192.7
[M+Na]+ 399.21554 201.5
[M-H]- 375.21904 195.8
[M+NH4]+ 394.26014 206.3
[M+K]+ 415.18948 194.2
[M+H-H2O]+ 359.22358 183.5
[M+HCOO]- 421.22452 212.3
[M+CH3COO]- 435.24017 202.1
[M+Na-2H]- 397.20099 197.8
[M]+ 376.22577 197.8
[M]- 376.22687 197.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe