CID 501387

5-methyl-n-(pyrrolidin-1-ylmethyl)pyrazine-2-carboxamide

Structural Information

Molecular Formula
C11H16N4O
SMILES
CC1=CN=C(C=N1)C(=O)NCN2CCCC2
InChI
InChI=1S/C11H16N4O/c1-9-6-13-10(7-12-9)11(16)14-8-15-4-2-3-5-15/h6-7H,2-5,8H2,1H3,(H,14,16)
InChIKey
IQUFDQHWBALLMD-UHFFFAOYSA-N
Compound name
5-methyl-N-(pyrrolidin-1-ylmethyl)pyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

220.13242 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.13970 150.3
[M+Na]+ 243.12164 156.1
[M-H]- 219.12514 152.5
[M+NH4]+ 238.16624 165.7
[M+K]+ 259.09558 153.5
[M+H-H2O]+ 203.12968 140.7
[M+HCOO]- 265.13062 170.0
[M+CH3COO]- 279.14627 189.1
[M+Na-2H]- 241.10709 153.9
[M]+ 220.13187 147.4
[M]- 220.13297 147.4
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.