CID 9570439

Benzoyl chloride, p-fluoro-, phenylhydrazone

Structural Information

Molecular Formula
C13H10ClFN2
SMILES
C1=CC=C(C=C1)N/N=C(/C2=CC=C(C=C2)F)\Cl
InChI
InChI=1S/C13H10ClFN2/c14-13(10-6-8-11(15)9-7-10)17-16-12-4-2-1-3-5-12/h1-9,16H/b17-13-
InChIKey
DWSYVIYQPRXBEU-LGMDPLHJSA-N
Compound name
(1Z)-4-fluoro-N-phenylbenzenecarbohydrazonoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

248.05165 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.05893 152.1
[M+Na]+ 271.04087 159.8
[M-H]- 247.04437 158.5
[M+NH4]+ 266.08547 169.9
[M+K]+ 287.01481 154.3
[M+H-H2O]+ 231.04891 144.0
[M+HCOO]- 293.04985 173.9
[M+CH3COO]- 307.06550 198.2
[M+Na-2H]- 269.02632 158.8
[M]+ 248.05110 151.5
[M]- 248.05220 151.5
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