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]+ 236.058516 149.9
[M+Na]+ 258.040458 158.1
[M-H]- 234.043964 152.7
[M+NH4]+ 253.085063 166.4
[M+K]+ 274.014398 152.5
[M+H-H2O]+ 218.048500 142.0
[M+HCOO]- 280.049441 167.7
[M+CH3COO]- 294.065091 186.9
[M+Na-2H]- 256.025906 154.6
[M]+ 235.05069142 149.6
[M]- 235.05178858 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.