CID 53393997

335161-24-5

Structural Information

Molecular Formula
C24H22FNO
SMILES
C1=CC=C2C(=C1)C=CC=C2C(=O)C3=CN(C4=CC=CC=C43)CCCCCF
InChI
InChI=1S/C24H22FNO/c25-15-6-1-7-16-26-17-22(20-12-4-5-14-23(20)26)24(27)21-13-8-10-18-9-2-3-11-19(18)21/h2-5,8-14,17H,1,6-7,15-16H2
InChIKey
ALQFAGFPQCBPED-UHFFFAOYSA-N
Compound name
[1-(5-fluoropentyl)indol-3-yl]-naphthalen-1-ylmethanone
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

37
References

116
Patents

359.16855 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 360.17583 188.7
[M+Na]+ 382.15777 204.4
[M+NH4]+ 377.20237 197.3
[M+K]+ 398.13171 195.4
[M-H]- 358.16127 192.9
[M+Na-2H]- 380.14322 196.4
[M]+ 359.16800 192.3
[M]- 359.16910 192.3
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