CID 2758406

640769-65-9

Structural Information

Molecular Formula

C₁₅H₁₄O₃

SMILES

COC1=C(C=C(C=C1)C2=CC=C(C=C2)C=O)OC

InChI

InChI=1S/C15H14O3/c1-17-14-8-7-13(9-15(14)18-2)12-5-3-11(10-16)4-6-12/h3-10H,1-2H3

InChIKey

GLQPTZAAUROJMO-UHFFFAOYSA-N

Compound name

4-(3,4-dimethoxyphenyl)benzaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3826
Patents: 242.0943 Da
Monoisotopic Mass: 2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	243.10158	153.3
[M+Na]+	265.08352	168.9
[M+NH4]+	260.12812	161.9
[M+K]+	281.05746	160.9
[M-H]-	241.08702	157.9
[M+Na-2H]-	263.06897	162.7
[M]+	242.09375	156.9
[M]-	242.09485	156.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe