CID 21925621

(2-amino-5-fluorophenyl)methanol

Structural Information

Molecular Formula
C7H8FNO
SMILES
C1=CC(=C(C=C1F)CO)N
InChI
InChI=1S/C7H8FNO/c8-6-1-2-7(9)5(3-6)4-10/h1-3,10H,4,9H2
InChIKey
ZRAZJGBWNZUSGQ-UHFFFAOYSA-N
Compound name
(2-amino-5-fluorophenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

92
Patents

141.05899 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.066266 124.9
[M+Na]+ 164.048208 133.8
[M-H]- 140.051714 126.1
[M+NH4]+ 159.092813 145.7
[M+K]+ 180.022148 131.1
[M+H-H2O]+ 124.056250 119.0
[M+HCOO]- 186.057191 148.2
[M+CH3COO]- 200.072841 173.8
[M+Na-2H]- 162.033656 130.9
[M]+ 141.05844142 121.5
[M]- 141.05953858 121.5
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