CID 84794175

2241138-24-7

Structural Information

Molecular Formula
C10H11F2NO3
SMILES
C1=CC(=CC=C1C(C(=O)O)N)OCC(F)F
InChI
InChI=1S/C10H11F2NO3/c11-8(12)5-16-7-3-1-6(2-4-7)9(13)10(14)15/h1-4,8-9H,5,13H2,(H,14,15)
InChIKey
PSZSOOOUJSNJBM-UHFFFAOYSA-N
Compound name
2-amino-2-[4-(2,2-difluoroethoxy)phenyl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.0707 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.07798 149.2
[M+Na]+ 254.05992 156.5
[M+NH4]+ 249.10452 153.9
[M+K]+ 270.03386 153.4
[M-H]- 230.06342 146.4
[M+Na-2H]- 252.04537 151.7
[M]+ 231.07015 148.8
[M]- 231.07125 148.8
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.