CID 735485

3-[(3,4-dichlorobenzyl)oxy]benzaldehyde

Structural Information

Molecular Formula
C14H10Cl2O2
SMILES
C1=CC(=CC(=C1)OCC2=CC(=C(C=C2)Cl)Cl)C=O
InChI
InChI=1S/C14H10Cl2O2/c15-13-5-4-11(7-14(13)16)9-18-12-3-1-2-10(6-12)8-17/h1-8H,9H2
InChIKey
SRNAKIRKGJOJIO-UHFFFAOYSA-N
Compound name
3-[(3,4-dichlorophenyl)methoxy]benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

280.0058 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.01308 157.5
[M+Na]+ 302.99502 175.0
[M+NH4]+ 298.03962 167.1
[M+K]+ 318.96896 165.2
[M-H]- 278.99852 162.4
[M+Na-2H]- 300.98047 167.6
[M]+ 280.00525 162.3
[M]- 280.00635 162.3
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