CID 54675867

O-hydroxylaminobenzoate

Structural Information

Molecular Formula
C7H6NO3
SMILES
C1=CC=C(C(=C1)C(=O)O)N[O-]
InChI
InChI=1S/C7H6NO3/c9-7(10)5-3-1-2-4-6(5)8-11/h1-4,8H,(H,9,10)/q-1
InChIKey
NGNQSUSYZJILIS-UHFFFAOYSA-N
Compound name
2-(oxidoamino)benzoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

0
Patents

152.03477 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.04205 125.3
[M+Na]+ 175.02399 132.5
[M-H]- 151.02749 126.4
[M+NH4]+ 170.06859 144.6
[M+K]+ 190.99793 131.6
[M+H-H2O]+ 135.03203 122.1
[M+HCOO]- 197.03297 149.3
[M+CH3COO]- 211.04862 171.2
[M+Na-2H]- 173.00944 131.6
[M]+ 152.03422 122.9
[M]- 152.03532 122.9
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