CID 24208866

912761-62-7

Structural Information

Molecular Formula
C13H20N4O
SMILES
CCN(C)C(=O)C1=C(N=CC=C1)N2CCNCC2
InChI
InChI=1S/C13H20N4O/c1-3-16(2)13(18)11-5-4-6-15-12(11)17-9-7-14-8-10-17/h4-6,14H,3,7-10H2,1-2H3
InChIKey
CMDQZBUDRBVXNM-UHFFFAOYSA-N
Compound name
N-ethyl-N-methyl-2-piperazin-1-ylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.16371 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.17099 159.8
[M+Na]+ 271.15293 163.7
[M-H]- 247.15643 161.3
[M+NH4]+ 266.19753 172.0
[M+K]+ 287.12687 160.9
[M+H-H2O]+ 231.16097 149.8
[M+HCOO]- 293.16191 175.7
[M+CH3COO]- 307.17756 196.5
[M+Na-2H]- 269.13838 163.0
[M]+ 248.16316 154.9
[M]- 248.16426 154.9
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.