CID 43589934

4-(3,5-dimethoxyphenoxy)benzaldehyde

Structural Information

Molecular Formula
C15H14O4
SMILES
COC1=CC(=CC(=C1)OC2=CC=C(C=C2)C=O)OC
InChI
InChI=1S/C15H14O4/c1-17-13-7-14(18-2)9-15(8-13)19-12-5-3-11(10-16)4-6-12/h3-10H,1-2H3
InChIKey
DCTJEWSCQVMUSN-UHFFFAOYSA-N
Compound name
4-(3,5-dimethoxyphenoxy)benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.0892 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.09648 156.5
[M+Na]+ 281.07842 171.6
[M+NH4]+ 276.12302 164.5
[M+K]+ 297.05236 164.2
[M-H]- 257.08192 160.5
[M+Na-2H]- 279.06387 165.5
[M]+ 258.08865 159.9
[M]- 258.08975 159.9
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

No patent data available for this compound.