CID 80104786

4-[(3-hydroxyphenyl)methoxy]benzaldehyde

Structural Information

Molecular Formula
C14H12O3
SMILES
C1=CC(=CC(=C1)O)COC2=CC=C(C=C2)C=O
InChI
InChI=1S/C14H12O3/c15-9-11-4-6-14(7-5-11)17-10-12-2-1-3-13(16)8-12/h1-9,16H,10H2
InChIKey
ZMDBCINTJBHMQM-UHFFFAOYSA-N
Compound name
4-[(3-hydroxyphenyl)methoxy]benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

228.07864 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.08592 148.3
[M+Na]+ 251.06786 156.5
[M-H]- 227.07136 154.1
[M+NH4]+ 246.11246 165.7
[M+K]+ 267.04180 152.9
[M+H-H2O]+ 211.07590 141.2
[M+HCOO]- 273.07684 172.1
[M+CH3COO]- 287.09249 187.0
[M+Na-2H]- 249.05331 154.6
[M]+ 228.07809 149.9
[M]- 228.07919 149.9
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.