CID 150223

89459-51-8

Structural Information

Molecular Formula
C19H22N4O
SMILES
CC1=C2C(=CC=C1)C(=C3C=CC=C(C3=N2)C(=O)NCCN(C)C)N
InChI
InChI=1S/C19H22N4O/c1-12-6-4-7-13-16(20)14-8-5-9-15(18(14)22-17(12)13)19(24)21-10-11-23(2)3/h4-9H,10-11H2,1-3H3,(H2,20,22)(H,21,24)
InChIKey
GZQOFEOTVUDSLP-UHFFFAOYSA-N
Compound name
9-amino-N-[2-(dimethylamino)ethyl]-5-methylacridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

5
Patents

322.17935 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.18663 177.5
[M+Na]+ 345.16857 185.4
[M-H]- 321.17207 182.8
[M+NH4]+ 340.21317 192.4
[M+K]+ 361.14251 181.1
[M+H-H2O]+ 305.17661 168.4
[M+HCOO]- 367.17755 200.5
[M+CH3COO]- 381.19320 222.9
[M+Na-2H]- 343.15402 183.3
[M]+ 322.17880 180.0
[M]- 322.17990 180.0
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