CID 67149

N-(4-hydroxyphenyl)glycine

Structural Information

Molecular Formula
C8H9NO3
SMILES
C1=CC(=CC=C1NCC(=O)O)O
InChI
InChI=1S/C8H9NO3/c10-7-3-1-6(2-4-7)9-5-8(11)12/h1-4,9-10H,5H2,(H,11,12)
InChIKey
WRUZLCLJULHLEY-UHFFFAOYSA-N
Compound name
2-(4-hydroxyanilino)acetic acid
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

263
References

33764
Patents

167.05824 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.065516 132.5
[M+Na]+ 190.047458 139.4
[M-H]- 166.050964 133.7
[M+NH4]+ 185.092063 151.2
[M+K]+ 206.021398 137.3
[M+H-H2O]+ 150.055500 126.9
[M+HCOO]- 212.056441 155.2
[M+CH3COO]- 226.072091 175.3
[M+Na-2H]- 188.032906 138.5
[M]+ 167.05769142 130.8
[M]- 167.05878858 130.8
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