CID 24692408

4-(3-chlorophenyl)-1-piperazineacetamidoxime

Structural Information

Molecular Formula
C12H17ClN4O
SMILES
C1CN(CCN1C/C(=N/O)/N)C2=CC(=CC=C2)Cl
InChI
InChI=1S/C12H17ClN4O/c13-10-2-1-3-11(8-10)17-6-4-16(5-7-17)9-12(14)15-18/h1-3,8,18H,4-7,9H2,(H2,14,15)
InChIKey
MRAAMUBGIXIHFJ-UHFFFAOYSA-N
Compound name
2-[4-(3-chlorophenyl)piperazin-1-yl]-N'-hydroxyethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

268.1091 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.11638 161.2
[M+Na]+ 291.09832 166.5
[M-H]- 267.10182 163.8
[M+NH4]+ 286.14292 174.6
[M+K]+ 307.07226 161.6
[M+H-H2O]+ 251.10636 152.6
[M+HCOO]- 313.10730 175.5
[M+CH3COO]- 327.12295 199.2
[M+Na-2H]- 289.08377 164.1
[M]+ 268.10855 156.8
[M]- 268.10965 156.8
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

patents stripe