CID 5273913

2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone

Structural Information

Molecular Formula
C14H12O4
SMILES
C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)C(O)O
InChI
InChI=1S/C14H12O4/c15-13(14(16)17)10-6-8-12(9-7-10)18-11-4-2-1-3-5-11/h1-9,14,16-17H
InChIKey
YXORSXKQALCDKI-UHFFFAOYSA-N
Compound name
2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

244.07356 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.08084 152.4
[M+Na]+ 267.06278 158.4
[M-H]- 243.06628 156.5
[M+NH4]+ 262.10738 167.7
[M+K]+ 283.03672 155.6
[M+H-H2O]+ 227.07082 145.3
[M+HCOO]- 289.07176 172.8
[M+CH3COO]- 303.08741 187.3
[M+Na-2H]- 265.04823 156.4
[M]+ 244.07301 151.9
[M]- 244.07411 151.9
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

No patent data available for this compound.