CID 11886

4-methylacridine

Structural Information

Molecular Formula
C14H11N
SMILES
CC1=CC=CC2=CC3=CC=CC=C3N=C12
InChI
InChI=1S/C14H11N/c1-10-5-4-7-12-9-11-6-2-3-8-13(11)15-14(10)12/h2-9H,1H3
InChIKey
SKLZCRNUJKGGRW-UHFFFAOYSA-N
Compound name
4-methylacridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

88
Patents

193.08914 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.09642 139.0
[M+Na]+ 216.07836 150.1
[M-H]- 192.08186 143.8
[M+NH4]+ 211.12296 159.7
[M+K]+ 232.05230 145.0
[M+H-H2O]+ 176.08640 131.7
[M+HCOO]- 238.08734 161.8
[M+CH3COO]- 252.10299 153.2
[M+Na-2H]- 214.06381 150.6
[M]+ 193.08859 140.8
[M]- 193.08969 140.8
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