CID 57504532

827588-33-0

Structural Information

Molecular Formula
C8H11N3O
SMILES
CN(C)C(=O)C1=CN=C(C=C1)N
InChI
InChI=1S/C8H11N3O/c1-11(2)8(12)6-3-4-7(9)10-5-6/h3-5H,1-2H3,(H2,9,10)
InChIKey
AYHNHPJQMDWONJ-UHFFFAOYSA-N
Compound name
6-amino-N,N-dimethylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

75
Patents

165.09021 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.097486 134.7
[M+Na]+ 188.079428 142.0
[M-H]- 164.082934 138.3
[M+NH4]+ 183.124033 153.9
[M+K]+ 204.053368 141.6
[M+H-H2O]+ 148.087470 127.6
[M+HCOO]- 210.088411 159.7
[M+CH3COO]- 224.104061 186.0
[M+Na-2H]- 186.064876 140.4
[M]+ 165.08966142 133.9
[M]- 165.09075858 133.9
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

patents stripe