CID 224214

2,2'-(ethylenedioxy)dibenzaldehyde

Structural Information

Molecular Formula
C16H14O4
SMILES
C1=CC=C(C(=C1)C=O)OCCOC2=CC=CC=C2C=O
InChI
InChI=1S/C16H14O4/c17-11-13-5-1-3-7-15(13)19-9-10-20-16-8-4-2-6-14(16)12-18/h1-8,11-12H,9-10H2
InChIKey
YXPZEGOFLHNCCI-UHFFFAOYSA-N
Compound name
2-[2-(2-formylphenoxy)ethoxy]benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

112
Patents

270.0892 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.09648 159.1
[M+Na]+ 293.07842 166.9
[M-H]- 269.08192 165.8
[M+NH4]+ 288.12302 175.1
[M+K]+ 309.05236 163.7
[M+H-H2O]+ 253.08646 151.0
[M+HCOO]- 315.08740 184.0
[M+CH3COO]- 329.10305 196.9
[M+Na-2H]- 291.06387 164.7
[M]+ 270.08865 163.9
[M]- 270.08975 163.9
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