CID 1392871

4'-methoxy-[1,1'-biphenyl]-3-carbaldehyde

Structural Information

Molecular Formula
C14H12O2
SMILES
COC1=CC=C(C=C1)C2=CC=CC(=C2)C=O
InChI
InChI=1S/C14H12O2/c1-16-14-7-5-12(6-8-14)13-4-2-3-11(9-13)10-15/h2-10H,1H3
InChIKey
MMXLQHMKFDEKHM-UHFFFAOYSA-N
Compound name
3-(4-methoxyphenyl)benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

212.08372 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.09100 144.5
[M+Na]+ 235.07294 153.3
[M-H]- 211.07644 151.7
[M+NH4]+ 230.11754 163.3
[M+K]+ 251.04688 149.9
[M+H-H2O]+ 195.08098 137.4
[M+HCOO]- 257.08192 169.6
[M+CH3COO]- 271.09757 187.5
[M+Na-2H]- 233.05839 151.2
[M]+ 212.08317 146.5
[M]- 212.08427 146.5
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