CID 74766004

1621019-96-2

Structural Information

Molecular Formula
C28H24N
SMILES
CC1=CC(=C(C(=C1)C)C2=C3C=CC=CC3=[N+](C4=CC=CC=C42)C5=CC=CC=C5)C
InChI
InChI=1S/C28H24N/c1-19-17-20(2)27(21(3)18-19)28-23-13-7-9-15-25(23)29(22-11-5-4-6-12-22)26-16-10-8-14-24(26)28/h4-18H,1-3H3/q+1
InChIKey
LPRVPPCEQXHJNY-UHFFFAOYSA-N
Compound name
10-phenyl-9-(2,4,6-trimethylphenyl)acridin-10-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

374.1909 Da
Monoisotopic Mass

8.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.19818 202.1
[M+Na]+ 397.18012 212.0
[M-H]- 373.18362 212.7
[M+NH4]+ 392.22472 214.2
[M+K]+ 413.15406 197.5
[M+H-H2O]+ 357.18816 192.3
[M+HCOO]- 419.18910 221.0
[M+CH3COO]- 433.20475 211.8
[M+Na-2H]- 395.16557 208.4
[M]+ 374.19035 202.9
[M]- 374.19145 202.9
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