CID 75506

4-benzyloxy-3-methoxybenzaldehyde

Structural Information

Molecular Formula
C15H14O3
SMILES
COC1=C(C=CC(=C1)C=O)OCC2=CC=CC=C2
InChI
InChI=1S/C15H14O3/c1-17-15-9-13(10-16)7-8-14(15)18-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3
InChIKey
JSHLOPGSDZTEGQ-UHFFFAOYSA-N
Compound name
3-methoxy-4-phenylmethoxybenzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

1078
Patents

242.0943 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.10158 153.7
[M+Na]+ 265.08352 168.9
[M+NH4]+ 260.12812 162.3
[M+K]+ 281.05746 160.7
[M-H]- 241.08702 158.2
[M+Na-2H]- 263.06897 163.3
[M]+ 242.09375 157.3
[M]- 242.09485 157.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe