CID 53746

Vufb-6792

Structural Information

Molecular Formula
C20H23N3O2
SMILES
CN(C)CCCNC(=O)CC1=C2C(=CC=C1)C(=O)C3=CC=CC=C3N2
InChI
InChI=1S/C20H23N3O2/c1-23(2)12-6-11-21-18(24)13-14-7-5-9-16-19(14)22-17-10-4-3-8-15(17)20(16)25/h3-5,7-10H,6,11-13H2,1-2H3,(H,21,24)(H,22,25)
InChIKey
JQTLEBREBWLRLO-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-2-(9-oxo-10H-acridin-4-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.17902 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.18630 179.7
[M+Na]+ 360.16824 186.7
[M-H]- 336.17174 183.6
[M+NH4]+ 355.21284 193.5
[M+K]+ 376.14218 181.6
[M+H-H2O]+ 320.17628 170.6
[M+HCOO]- 382.17722 200.9
[M+CH3COO]- 396.19287 219.1
[M+Na-2H]- 358.15369 185.9
[M]+ 337.17847 182.7
[M]- 337.17957 182.7
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.