CID 124128872

3bmeo-2odfp

Structural Information

Molecular Formula
C24H24F2O2
SMILES
CCCC1=CC=C(C=C1)C2=CC=C(C=C2)COC3=C(C(=C(C=C3)OCC)F)F
InChI
InChI=1S/C24H24F2O2/c1-3-5-17-6-10-19(11-7-17)20-12-8-18(9-13-20)16-28-22-15-14-21(27-4-2)23(25)24(22)26/h6-15H,3-5,16H2,1-2H3
InChIKey
WOFPYNOBGHNBGC-UHFFFAOYSA-N
Compound name
1-ethoxy-2,3-difluoro-4-[[4-(4-propylphenyl)phenyl]methoxy]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

382.17444 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.18172 193.5
[M+Na]+ 405.16366 201.6
[M-H]- 381.16716 200.5
[M+NH4]+ 400.20826 205.3
[M+K]+ 421.13760 195.1
[M+H-H2O]+ 365.17170 181.5
[M+HCOO]- 427.17264 213.8
[M+CH3COO]- 441.18829 222.8
[M+Na-2H]- 403.14911 193.4
[M]+ 382.17389 195.8
[M]- 382.17499 195.8
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

patents stripe