CID 95888

4-(hydroxyamino)benzoic acid

Structural Information

Molecular Formula
C7H7NO3
SMILES
C1=CC(=CC=C1C(=O)O)NO
InChI
InChI=1S/C7H7NO3/c9-7(10)5-1-3-6(8-11)4-2-5/h1-4,8,11H,(H,9,10)
InChIKey
ZIJKJLVJUJMAOP-UHFFFAOYSA-N
Compound name
4-(hydroxyamino)benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

153.04259 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.049866 127.9
[M+Na]+ 176.031808 135.2
[M-H]- 152.035314 129.3
[M+NH4]+ 171.076413 147.2
[M+K]+ 192.005748 133.4
[M+H-H2O]+ 136.039850 122.5
[M+HCOO]- 198.040791 151.0
[M+CH3COO]- 212.056441 172.3
[M+Na-2H]- 174.017256 134.5
[M]+ 153.04204142 125.8
[M]- 153.04313858 125.8
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.