CID 56966857

1372127-42-8

Structural Information

Molecular Formula
C9H13N3O
SMILES
CC1=CC(=CC(=N1)N)C(=O)N(C)C
InChI
InChI=1S/C9H13N3O/c1-6-4-7(5-8(10)11-6)9(13)12(2)3/h4-5H,1-3H3,(H2,10,11)
InChIKey
QLMUMHYEALQXDG-UHFFFAOYSA-N
Compound name
2-amino-N,N,6-trimethylpyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

179.10587 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.11315 139.1
[M+Na]+ 202.09509 147.0
[M-H]- 178.09859 143.0
[M+NH4]+ 197.13969 158.2
[M+K]+ 218.06903 146.4
[M+H-H2O]+ 162.10313 132.1
[M+HCOO]- 224.10407 163.8
[M+CH3COO]- 238.11972 190.2
[M+Na-2H]- 200.08054 143.6
[M]+ 179.10532 139.1
[M]- 179.10642 139.1
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

patents stripe