CID 17999360

6-chloro-2-fluoro-3-methoxybenzamide

Structural Information

Molecular Formula
C8H7ClFNO2
SMILES
COC1=C(C(=C(C=C1)Cl)C(=O)N)F
InChI
InChI=1S/C8H7ClFNO2/c1-13-5-3-2-4(9)6(7(5)10)8(11)12/h2-3H,1H3,(H2,11,12)
InChIKey
AZUOJQIOSGRMMS-UHFFFAOYSA-N
Compound name
6-chloro-2-fluoro-3-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

13
Patents

203.01494 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.02222 136.4
[M+Na]+ 226.00416 148.6
[M+NH4]+ 221.04876 144.0
[M+K]+ 241.97810 143.1
[M-H]- 202.00766 137.0
[M+Na-2H]- 223.98961 142.0
[M]+ 203.01439 138.4
[M]- 203.01549 138.4
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