CID 364426

Nsc630686

Structural Information

Molecular Formula
C22H18N2O
SMILES
CCOC1=CC=C(C=C1)N=CC2=C3C=CC=CC3=NC4=CC=CC=C42
InChI
InChI=1S/C22H18N2O/c1-2-25-17-13-11-16(12-14-17)23-15-20-18-7-3-5-9-21(18)24-22-10-6-4-8-19(20)22/h3-15H,2H2,1H3
InChIKey
MGZADRFESIEWRI-UHFFFAOYSA-N
Compound name
1-acridin-9-yl-N-(4-ethoxyphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.1419 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.14918 177.8
[M+Na]+ 349.13112 187.1
[M-H]- 325.13462 186.2
[M+NH4]+ 344.17572 192.6
[M+K]+ 365.10506 180.3
[M+H-H2O]+ 309.13916 166.9
[M+HCOO]- 371.14010 201.5
[M+CH3COO]- 385.15575 189.3
[M+Na-2H]- 347.11657 187.2
[M]+ 326.14135 181.4
[M]- 326.14245 181.4
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.