CID 14221338

3-fluoro-n-hydroxybenzene-1-carbonimidoyl chloride

Structural Information

Molecular Formula
C7H5ClFNO
SMILES
C1=CC(=CC(=C1)F)/C(=N/O)/Cl
InChI
InChI=1S/C7H5ClFNO/c8-7(10-11)5-2-1-3-6(9)4-5/h1-4,11H/b10-7-
InChIKey
CQEGJGFPGPNQNG-YFHOEESVSA-N
Compound name
(1Z)-3-fluoro-N-hydroxybenzenecarboximidoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

67
Patents

173.00436 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.01164 129.3
[M+Na]+ 195.99358 138.6
[M-H]- 171.99708 132.0
[M+NH4]+ 191.03818 150.3
[M+K]+ 211.96752 135.0
[M+H-H2O]+ 156.00162 123.9
[M+HCOO]- 218.00256 149.4
[M+CH3COO]- 232.01821 179.0
[M+Na-2H]- 193.97903 135.9
[M]+ 173.00381 129.0
[M]- 173.00491 129.0
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