CID 3054370

Brn 1488000

Structural Information

Molecular Formula
C20H21NO
SMILES
CN1C2=CC=CC=C2C(C3=CC=CC=C31)C4CCCCC4=O
InChI
InChI=1S/C20H21NO/c1-21-17-11-5-2-8-14(17)20(15-9-3-6-12-18(15)21)16-10-4-7-13-19(16)22/h2-3,5-6,8-9,11-12,16,20H,4,7,10,13H2,1H3
InChIKey
YYLKUZRZKIMQIW-UHFFFAOYSA-N
Compound name
2-(10-methyl-9H-acridin-9-yl)cyclohexan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.16232 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.16960 170.3
[M+Na]+ 314.15154 186.3
[M+NH4]+ 309.19614 180.8
[M+K]+ 330.12548 176.2
[M-H]- 290.15504 176.6
[M+Na-2H]- 312.13699 177.8
[M]+ 291.16177 174.6
[M]- 291.16287 174.6
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.