CID 6914396

Ethanone, 1-(4-chlorophenyl)-, o-(2-(dimethylamino)ethyl)oxime, hydrochloride

Structural Information

Molecular Formula
C12H17ClN2O
SMILES
C/C(=N/OCCN(C)C)/C1=CC=C(C=C1)Cl
InChI
InChI=1S/C12H17ClN2O/c1-10(14-16-9-8-15(2)3)11-4-6-12(13)7-5-11/h4-7H,8-9H2,1-3H3/b14-10-
InChIKey
ZEWPZWZBVHCPOR-UVTDQMKNSA-N
Compound name
2-[(Z)-1-(4-chlorophenyl)ethylideneamino]oxy-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

240.10294 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.110216 155.2
[M+Na]+ 263.092158 162.0
[M-H]- 239.095664 161.2
[M+NH4]+ 258.136763 174.5
[M+K]+ 279.066098 159.8
[M+H-H2O]+ 223.100200 148.7
[M+HCOO]- 285.101141 177.7
[M+CH3COO]- 299.116791 202.4
[M+Na-2H]- 261.077606 159.5
[M]+ 240.10239142 160.3
[M]- 240.10348858 160.3
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.