CID 23391165

6fmeot

Structural Information

Molecular Formula
C25H27FO
SMILES
CCCCCCC1=CC=C(C=C1)C2=C(C=C(C=C2)C3=CC=C(C=C3)OC)F
InChI
InChI=1S/C25H27FO/c1-3-4-5-6-7-19-8-10-21(11-9-19)24-17-14-22(18-25(24)26)20-12-15-23(27-2)16-13-20/h8-18H,3-7H2,1-2H3
InChIKey
OWWXYKGXKHLJCV-UHFFFAOYSA-N
Compound name
2-fluoro-1-(4-hexylphenyl)-4-(4-methoxyphenyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

362.2046 Da
Monoisotopic Mass

8.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.21188 191.1
[M+Na]+ 385.19382 197.8
[M-H]- 361.19732 198.9
[M+NH4]+ 380.23842 203.6
[M+K]+ 401.16776 190.9
[M+H-H2O]+ 345.20186 180.0
[M+HCOO]- 407.20280 211.9
[M+CH3COO]- 421.21845 219.9
[M+Na-2H]- 383.17927 191.7
[M]+ 362.20405 192.9
[M]- 362.20515 192.9
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

patents stripe