CID 3869296

324773-19-5

Structural Information

Molecular Formula
C22H22N2O
SMILES
CCC1=CC=C(C=C1)NC(=O)C2=C3CCCCC3=NC4=CC=CC=C42
InChI
InChI=1S/C22H22N2O/c1-2-15-11-13-16(14-12-15)23-22(25)21-17-7-3-5-9-19(17)24-20-10-6-4-8-18(20)21/h3,5,7,9,11-14H,2,4,6,8,10H2,1H3,(H,23,25)
InChIKey
VYNIHIICUDRYSV-UHFFFAOYSA-N
Compound name
N-(4-ethylphenyl)-1,2,3,4-tetrahydroacridine-9-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

330.17322 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.18050 179.0
[M+Na]+ 353.16244 184.4
[M-H]- 329.16594 184.9
[M+NH4]+ 348.20704 192.6
[M+K]+ 369.13638 178.0
[M+H-H2O]+ 313.17048 168.7
[M+HCOO]- 375.17142 196.1
[M+CH3COO]- 389.18707 188.2
[M+Na-2H]- 351.14789 184.1
[M]+ 330.17267 176.1
[M]- 330.17377 176.1
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.