CID 735467

4-[(2-chloro-6-fluorophenyl)methoxy]benzaldehyde

Structural Information

Molecular Formula
C14H10ClFO2
SMILES
C1=CC(=C(C(=C1)Cl)COC2=CC=C(C=C2)C=O)F
InChI
InChI=1S/C14H10ClFO2/c15-13-2-1-3-14(16)12(13)9-18-11-6-4-10(8-17)5-7-11/h1-8H,9H2
InChIKey
WOUZCDNRKXWPDY-UHFFFAOYSA-N
Compound name
4-[(2-chloro-6-fluorophenyl)methoxy]benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

264.03534 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.04262 153.3
[M+Na]+ 287.02456 163.9
[M-H]- 263.02806 159.2
[M+NH4]+ 282.06916 171.1
[M+K]+ 302.99850 158.2
[M+H-H2O]+ 247.03260 146.0
[M+HCOO]- 309.03354 172.7
[M+CH3COO]- 323.04919 195.1
[M+Na-2H]- 285.01001 158.2
[M]+ 264.03479 156.9
[M]- 264.03589 156.9
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