CID 9604798

1-(4-chlorophenyl)-2-(1h-imidazol-2-yl)ethanone oxime

Structural Information

Molecular Formula
C11H10ClN3O
SMILES
C1=CC(=CC=C1/C(=N\O)/CC2=NC=CN2)Cl
InChI
InChI=1S/C11H10ClN3O/c12-9-3-1-8(2-4-9)10(15-16)7-11-13-5-6-14-11/h1-6,16H,7H2,(H,13,14)/b15-10-
InChIKey
YRAPNMZPUZCCFK-GDNBJRDFSA-N
Compound name
(NZ)-N-[1-(4-chlorophenyl)-2-(1H-imidazol-2-yl)ethylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.05124 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.05852 149.9
[M+Na]+ 258.04046 158.1
[M-H]- 234.04396 152.7
[M+NH4]+ 253.08506 166.4
[M+K]+ 274.01440 152.5
[M+H-H2O]+ 218.04850 142.0
[M+HCOO]- 280.04944 167.7
[M+CH3COO]- 294.06509 186.9
[M+Na-2H]- 256.02591 154.6
[M]+ 235.05069 149.6
[M]- 235.05179 149.6
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

No patent data available for this compound.