CID 304267

6964-54-1

Structural Information

Molecular Formula
C7H9N3O
SMILES
CN1C=C(C=CC1=N)C(=O)N
InChI
InChI=1S/C7H9N3O/c1-10-4-5(7(9)11)2-3-6(10)8/h2-4,8H,1H3,(H2,9,11)
InChIKey
MVBYQDQBUVTQTK-UHFFFAOYSA-N
Compound name
6-imino-1-methylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

151.07455 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.08183 129.1
[M+Na]+ 174.06377 137.9
[M-H]- 150.06727 131.8
[M+NH4]+ 169.10837 148.5
[M+K]+ 190.03771 135.7
[M+H-H2O]+ 134.07181 122.7
[M+HCOO]- 196.07275 154.1
[M+CH3COO]- 210.08840 180.5
[M+Na-2H]- 172.04922 135.3
[M]+ 151.07400 126.5
[M]- 151.07510 126.5
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.