CID 7365

Phenylarsonic acid

Structural Information

Molecular Formula
C6H7AsO3
SMILES
C1=CC=C(C=C1)[As](=O)(O)O
InChI
InChI=1S/C6H7AsO3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H,(H2,8,9,10)
InChIKey
LVKZSFMYNWRPJX-UHFFFAOYSA-N
Compound name
phenylarsonic acid
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

68
References

1664
Patents

201.96112 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.96840 136.1
[M+Na]+ 224.95034 143.7
[M-H]- 200.95384 137.0
[M+NH4]+ 219.99494 155.7
[M+K]+ 240.92428 141.5
[M+H-H2O]+ 184.95838 131.0
[M+HCOO]- 246.95932 157.0
[M+CH3COO]- 260.97497 167.7
[M+Na-2H]- 222.93579 143.9
[M]+ 201.96057 134.6
[M]- 201.96167 134.6
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