CID 85806

2,3-dihydroxy-1,2-diphenylpropan-1-one

Structural Information

Molecular Formula
C15H14O3
SMILES
C1=CC=C(C=C1)C(=O)C(CO)(C2=CC=CC=C2)O
InChI
InChI=1S/C15H14O3/c16-11-15(18,13-9-5-2-6-10-13)14(17)12-7-3-1-4-8-12/h1-10,16,18H,11H2
InChIKey
AOGNACZDZNOTSN-UHFFFAOYSA-N
Compound name
2,3-dihydroxy-1,2-diphenylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1094
Patents

242.0943 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.101576 154.0
[M+Na]+ 265.083518 159.6
[M-H]- 241.087024 157.8
[M+NH4]+ 260.128123 169.4
[M+K]+ 281.057458 155.7
[M+H-H2O]+ 225.091560 147.4
[M+HCOO]- 287.092501 173.3
[M+CH3COO]- 301.108151 186.5
[M+Na-2H]- 263.068966 160.2
[M]+ 242.09375142 152.2
[M]- 242.09484858 152.2
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