CID 5247041

9-mesityl-10-methylacridinium perchlorate

Structural Information

Molecular Formula
C23H22N
SMILES
CC1=CC(=C(C(=C1)C)C2=C3C=CC=CC3=[N+](C4=CC=CC=C42)C)C
InChI
InChI=1S/C23H22N/c1-15-13-16(2)22(17(3)14-15)23-18-9-5-7-11-20(18)24(4)21-12-8-6-10-19(21)23/h5-14H,1-4H3/q+1
InChIKey
LULZXNOVLBISGB-UHFFFAOYSA-N
Compound name
10-methyl-9-(2,4,6-trimethylphenyl)acridin-10-ium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

25
References

186
Patents

312.17523 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.18251 181.2
[M+Na]+ 335.16445 192.5
[M-H]- 311.16795 189.5
[M+NH4]+ 330.20905 196.9
[M+K]+ 351.13839 179.6
[M+H-H2O]+ 295.17249 174.0
[M+HCOO]- 357.17343 201.2
[M+CH3COO]- 371.18908 207.3
[M+Na-2H]- 333.14990 188.6
[M]+ 312.17468 183.5
[M]- 312.17578 183.5
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