CID 107380

1,2-bis(4-hydroxyphenyl)ethane-1,2-diol

Structural Information

Molecular Formula
C14H14O4
SMILES
C1=CC(=CC=C1C(C(C2=CC=C(C=C2)O)O)O)O
InChI
InChI=1S/C14H14O4/c15-11-5-1-9(2-6-11)13(17)14(18)10-3-7-12(16)8-4-10/h1-8,13-18H
InChIKey
GRCDZLQANHNACB-UHFFFAOYSA-N
Compound name
1,2-bis(4-hydroxyphenyl)ethane-1,2-diol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

27
Patents

246.0892 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.09648 155.0
[M+Na]+ 269.07842 166.9
[M+NH4]+ 264.12302 161.7
[M+K]+ 285.05236 162.6
[M-H]- 245.08192 156.8
[M+Na-2H]- 267.06387 161.3
[M]+ 246.08865 157.0
[M]- 246.08975 157.0
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