CID 44630610

5-ethyl-1-methylpiperazin-2-one

Structural Information

Molecular Formula
C7H14N2O
SMILES
CCC1CN(C(=O)CN1)C
InChI
InChI=1S/C7H14N2O/c1-3-6-5-9(2)7(10)4-8-6/h6,8H,3-5H2,1-2H3
InChIKey
QLFQFGAIOKXHLN-UHFFFAOYSA-N
Compound name
5-ethyl-1-methylpiperazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.11061 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.117886 132.1
[M+Na]+ 165.099828 139.1
[M-H]- 141.103334 131.3
[M+NH4]+ 160.144433 150.6
[M+K]+ 181.073768 137.2
[M+H-H2O]+ 125.107870 125.7
[M+HCOO]- 187.108811 149.3
[M+CH3COO]- 201.124461 172.5
[M+Na-2H]- 163.085276 136.4
[M]+ 142.11006142 127.7
[M]- 142.11115858 127.7
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.