CID 9588890

N-acetyl-n'-(1-hydroxyimino-2-oxopropyl)piperazine

Structural Information

Molecular Formula
C9H15N3O3
SMILES
CC(=O)/C(=N\O)/N1CCN(CC1)C(=O)C
InChI
InChI=1S/C9H15N3O3/c1-7(13)9(10-15)12-5-3-11(4-6-12)8(2)14/h15H,3-6H2,1-2H3/b10-9+
InChIKey
WIUXDGUEFQCTJK-MDZDMXLPSA-N
Compound name
(1E)-1-(4-acetylpiperazin-1-yl)-1-hydroxyiminopropan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.11134 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.11862 147.9
[M+Na]+ 236.10056 152.5
[M-H]- 212.10406 148.1
[M+NH4]+ 231.14516 163.2
[M+K]+ 252.07450 152.3
[M+H-H2O]+ 196.10860 140.4
[M+HCOO]- 258.10954 164.8
[M+CH3COO]- 272.12519 188.1
[M+Na-2H]- 234.08601 149.3
[M]+ 213.11079 144.3
[M]- 213.11189 144.3
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.