CID 3088916

119585-20-5

Structural Information

Molecular Formula
C24H26FNO2
SMILES
CN(C)CCCC(COC(=O)C1=CC=C(C=C1)F)C2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C24H26FNO2/c1-26(2)16-6-9-20(17-28-24(27)19-12-14-21(25)15-13-19)23-11-5-8-18-7-3-4-10-22(18)23/h3-5,7-8,10-15,20H,6,9,16-17H2,1-2H3
InChIKey
LNMQNGAQQLPLCJ-UHFFFAOYSA-N
Compound name
[5-(dimethylamino)-2-naphthalen-1-ylpentyl] 4-fluorobenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

379.19476 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 380.202036 194.6
[M+Na]+ 402.183978 198.7
[M-H]- 378.187484 200.8
[M+NH4]+ 397.228583 207.0
[M+K]+ 418.157918 194.4
[M+H-H2O]+ 362.192020 183.7
[M+HCOO]- 424.192961 214.0
[M+CH3COO]- 438.208611 226.9
[M+Na-2H]- 400.169426 195.4
[M]+ 379.19421142 196.6
[M]- 379.19530858 196.6
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.