CID 51252

Brn 0447415

Structural Information

Molecular Formula
C24H28N2O
SMILES
CN1C2=CC=CC=C2C(C3=CC=CC=C31)C4CCCC=C4N5CCOCC5
InChI
InChI=1S/C24H28N2O/c1-25-21-11-5-2-8-18(21)24(19-9-3-6-12-22(19)25)20-10-4-7-13-23(20)26-14-16-27-17-15-26/h2-3,5-6,8-9,11-13,20,24H,4,7,10,14-17H2,1H3
InChIKey
QZSLNDSDNXPXNA-UHFFFAOYSA-N
Compound name
4-[6-(10-methyl-9H-acridin-9-yl)cyclohexen-1-yl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.22015 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.22743 190.4
[M+Na]+ 383.20937 194.0
[M-H]- 359.21287 197.2
[M+NH4]+ 378.25397 199.6
[M+K]+ 399.18331 188.0
[M+H-H2O]+ 343.21741 177.3
[M+HCOO]- 405.21835 199.5
[M+CH3COO]- 419.23400 197.4
[M+Na-2H]- 381.19482 192.2
[M]+ 360.21960 182.8
[M]- 360.22070 182.8
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.