CID 6914397

P-chloroacetophenone-o-(2-diethylaminoethyl)oxime hydrochloride

Structural Information

Molecular Formula
C14H21ClN2O
SMILES
CCN(CC)CCO/N=C(/C)\C1=CC=C(C=C1)Cl
InChI
InChI=1S/C14H21ClN2O/c1-4-17(5-2)10-11-18-16-12(3)13-6-8-14(15)9-7-13/h6-9H,4-5,10-11H2,1-3H3/b16-12-
InChIKey
ZWDXBSDPAOLKCD-VBKFSLOCSA-N
Compound name
2-[(Z)-1-(4-chlorophenyl)ethylideneamino]oxy-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.13425 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.14153 164.6
[M+Na]+ 291.12347 170.5
[M-H]- 267.12697 170.2
[M+NH4]+ 286.16807 182.8
[M+K]+ 307.09741 167.9
[M+H-H2O]+ 251.13151 157.7
[M+HCOO]- 313.13245 186.4
[M+CH3COO]- 327.14810 208.4
[M+Na-2H]- 289.10892 167.8
[M]+ 268.13370 170.5
[M]- 268.13480 170.5
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

No patent data available for this compound.