CID 183279

Sr 95444a

Structural Information

Molecular Formula
C19H26N4O
SMILES
CCN(CC)CCCNC1=NC=C(C2=C1C3=C(N2)C=CC(=C3)O)C
InChI
InChI=1S/C19H26N4O/c1-4-23(5-2)10-6-9-20-19-17-15-11-14(24)7-8-16(15)22-18(17)13(3)12-21-19/h7-8,11-12,22,24H,4-6,9-10H2,1-3H3,(H,20,21)
InChIKey
LUDLZUSBYUJHLT-UHFFFAOYSA-N
Compound name
1-[3-(diethylamino)propylamino]-4-methyl-5H-pyrido[4,3-b]indol-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

326.21066 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.21794 180.1
[M+Na]+ 349.19988 191.9
[M+NH4]+ 344.24448 187.3
[M+K]+ 365.17382 186.3
[M-H]- 325.20338 182.6
[M+Na-2H]- 347.18533 184.2
[M]+ 326.21011 182.4
[M]- 326.21121 182.4
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