CID 66127

8,10-dimethylbenz(a)acridine

Structural Information

Molecular Formula
C19H15N
SMILES
CC1=CC(=C2C(=C1)C=C3C(=N2)C=CC4=CC=CC=C43)C
InChI
InChI=1S/C19H15N/c1-12-9-13(2)19-15(10-12)11-17-16-6-4-3-5-14(16)7-8-18(17)20-19/h3-11H,1-2H3
InChIKey
QJPFZQCEUDMYTG-UHFFFAOYSA-N
Compound name
8,10-dimethylbenzo[a]acridine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

257.12045 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.12773 158.8
[M+Na]+ 280.10967 170.6
[M-H]- 256.11317 164.5
[M+NH4]+ 275.15427 177.9
[M+K]+ 296.08361 163.5
[M+H-H2O]+ 240.11771 150.0
[M+HCOO]- 302.11865 179.1
[M+CH3COO]- 316.13430 171.7
[M+Na-2H]- 278.09512 168.7
[M]+ 257.11990 161.4
[M]- 257.12100 161.4
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.