CID 3056456

73790-23-5

Structural Information

Molecular Formula
C25H25N3O
SMILES
CN(C)C(=O)CCCC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42
InChI
InChI=1S/C25H25N3O/c1-28(2)24(29)13-7-8-18-14-16-19(17-15-18)26-25-20-9-3-5-11-22(20)27-23-12-6-4-10-21(23)25/h3-6,9-12,14-17H,7-8,13H2,1-2H3,(H,26,27)
InChIKey
BTCFQYRTEZAKLN-UHFFFAOYSA-N
Compound name
4-[4-(acridin-9-ylamino)phenyl]-N,N-dimethylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

383.19977 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 384.207046 194.5
[M+Na]+ 406.188988 200.6
[M-H]- 382.192494 202.2
[M+NH4]+ 401.233593 206.3
[M+K]+ 422.162928 194.5
[M+H-H2O]+ 366.197030 183.1
[M+HCOO]- 428.197971 216.1
[M+CH3COO]- 442.213621 203.8
[M+Na-2H]- 404.174436 200.8
[M]+ 383.19922142 197.3
[M]- 383.20031858 197.3
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.