CID 3080044

Brn 4269117

Structural Information

Molecular Formula
C21H25N3O
SMILES
CC1(CC2=C(C=CC(=O)N2CCN(C)C)C3=C1C4=CC=CC=C4N3)C
InChI
InChI=1S/C21H25N3O/c1-21(2)13-17-15(9-10-18(25)24(17)12-11-23(3)4)20-19(21)14-7-5-6-8-16(14)22-20/h5-10,22H,11-13H2,1-4H3
InChIKey
LYYHJNOOMFAYMG-UHFFFAOYSA-N
Compound name
4-[2-(dimethylamino)ethyl]-6,6-dimethyl-5,11-dihydropyrido[3,2-a]carbazol-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.19977 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.20705 181.6
[M+Na]+ 358.18899 196.5
[M+NH4]+ 353.23359 191.7
[M+K]+ 374.16293 187.6
[M-H]- 334.19249 185.2
[M+Na-2H]- 356.17444 187.7
[M]+ 335.19922 185.0
[M]- 335.20032 185.0
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.