CID 6914398

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

Structural Information

Molecular Formula
C14H19ClN2O
SMILES
C/C(=N/OCCN1CCCC1)/C2=CC=C(C=C2)Cl
InChI
InChI=1S/C14H19ClN2O/c1-12(13-4-6-14(15)7-5-13)16-18-11-10-17-8-2-3-9-17/h4-7H,2-3,8-11H2,1H3/b16-12-
InChIKey
PITONXVHZQRZMF-VBKFSLOCSA-N
Compound name
(Z)-1-(4-chlorophenyl)-N-(2-pyrrolidin-1-ylethoxy)ethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

266.1186 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.125876 163.2
[M+Na]+ 289.107818 168.9
[M-H]- 265.111324 168.8
[M+NH4]+ 284.152423 181.0
[M+K]+ 305.081758 164.7
[M+H-H2O]+ 249.115860 155.0
[M+HCOO]- 311.116801 181.4
[M+CH3COO]- 325.132451 198.9
[M+Na-2H]- 287.093266 164.9
[M]+ 266.11805142 164.2
[M]- 266.11914858 164.2
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.