CID 122163945

2,2-dimethoxy-1-(piperazin-1-yl)ethan-1-one

Structural Information

Molecular Formula
C8H16N2O3
SMILES
COC(C(=O)N1CCNCC1)OC
InChI
InChI=1S/C8H16N2O3/c1-12-8(13-2)7(11)10-5-3-9-4-6-10/h8-9H,3-6H2,1-2H3
InChIKey
ADJDPVCAPUELNM-UHFFFAOYSA-N
Compound name
2,2-dimethoxy-1-piperazin-1-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.11609 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.123366 142.9
[M+Na]+ 211.105308 146.9
[M-H]- 187.108814 141.3
[M+NH4]+ 206.149913 158.6
[M+K]+ 227.079248 146.8
[M+H-H2O]+ 171.113350 135.5
[M+HCOO]- 233.114291 158.2
[M+CH3COO]- 247.129941 178.5
[M+Na-2H]- 209.090756 145.7
[M]+ 188.11554142 139.6
[M]- 188.11663858 139.6
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.