CID 22482821

5-chloro-2-fluorophenol

Structural Information

Molecular Formula
C6H4ClFO
SMILES
C1=CC(=C(C=C1Cl)O)F
InChI
InChI=1S/C6H4ClFO/c7-4-1-2-5(8)6(9)3-4/h1-3,9H
InChIKey
OYEGPBZYKCARCW-UHFFFAOYSA-N
Compound name
5-chloro-2-fluorophenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

195
Patents

145.99347 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.00075 120.3
[M+Na]+ 168.98269 131.3
[M-H]- 144.98619 122.2
[M+NH4]+ 164.02729 142.5
[M+K]+ 184.95663 127.4
[M+H-H2O]+ 128.99073 116.0
[M+HCOO]- 190.99167 139.1
[M+CH3COO]- 205.00732 170.5
[M+Na-2H]- 166.96814 127.5
[M]+ 145.99292 120.3
[M]- 145.99402 120.3
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

patents stripe