CID 82651170

1501396-73-1

Structural Information

Molecular Formula
C6H9N3O
SMILES
C1CNCC2=C1NC(=O)N2
InChI
InChI=1S/C6H9N3O/c10-6-8-4-1-2-7-3-5(4)9-6/h7H,1-3H2,(H2,8,9,10)
InChIKey
GYMJWRLDQXXOIX-UHFFFAOYSA-N
Compound name
1,3,4,5,6,7-hexahydroimidazo[4,5-c]pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

139.07455 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.08183 128.2
[M+Na]+ 162.06377 136.2
[M-H]- 138.06727 124.5
[M+NH4]+ 157.10837 146.5
[M+K]+ 178.03771 131.8
[M+H-H2O]+ 122.07181 121.5
[M+HCOO]- 184.07275 143.4
[M+CH3COO]- 198.08840 139.6
[M+Na-2H]- 160.04922 134.1
[M]+ 139.07400 120.9
[M]- 139.07510 120.9
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