CID 279186

2-[hydroxy(phenyl)phosphoryl]benzoic acid

Structural Information

Molecular Formula
C13H11O4P
SMILES
C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2C(=O)O)O
InChI
InChI=1S/C13H11O4P/c14-13(15)11-8-4-5-9-12(11)18(16,17)10-6-2-1-3-7-10/h1-9H,(H,14,15)(H,16,17)
InChIKey
YZBFTNBIUIQVLE-UHFFFAOYSA-N
Compound name
2-[hydroxy(phenyl)phosphoryl]benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

262.0395 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.04678 157.5
[M+Na]+ 285.02872 164.2
[M-H]- 261.03222 160.6
[M+NH4]+ 280.07332 172.7
[M+K]+ 301.00266 160.9
[M+H-H2O]+ 245.03676 148.6
[M+HCOO]- 307.03770 182.8
[M+CH3COO]- 321.05335 189.9
[M+Na-2H]- 283.01417 160.1
[M]+ 262.03895 157.1
[M]- 262.04005 157.1
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.