CID 11182709

2-amino-4-hydroxybenzoic acid

Structural Information

Molecular Formula
C7H7NO3
SMILES
C1=CC(=C(C=C1O)N)C(=O)O
InChI
InChI=1S/C7H7NO3/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3,9H,8H2,(H,10,11)
InChIKey
DPELYVFAULJYNX-UHFFFAOYSA-N
Compound name
2-amino-4-hydroxybenzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

264
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 128.2
[M+Na]+ 176.031808 136.5
[M-H]- 152.035314 129.5
[M+NH4]+ 171.076413 147.6
[M+K]+ 192.005748 134.4
[M+H-H2O]+ 136.039850 123.1
[M+HCOO]- 198.040791 150.6
[M+CH3COO]- 212.056441 172.9
[M+Na-2H]- 174.017256 133.0
[M]+ 153.04204142 125.6
[M]- 153.04313858 125.6
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