CID 9588890

Piperazine, 1-acetyl-4-(1-(hydroxyimino)-2-oxopropyl)-

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]+ 214.118616 147.9
[M+Na]+ 236.100558 152.5
[M-H]- 212.104064 148.1
[M+NH4]+ 231.145163 163.2
[M+K]+ 252.074498 152.3
[M+H-H2O]+ 196.108600 140.4
[M+HCOO]- 258.109541 164.8
[M+CH3COO]- 272.125191 188.1
[M+Na-2H]- 234.086006 149.3
[M]+ 213.11079142 144.3
[M]- 213.11188858 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.