CID 55899

N-methyl-1,6-diazabicyclo(3.1.0)hexane-5-carboxamide

Structural Information

Molecular Formula
C6H11N3O
SMILES
CNC(=O)C12CCCN1N2
InChI
InChI=1S/C6H11N3O/c1-7-5(10)6-3-2-4-9(6)8-6/h8H,2-4H2,1H3,(H,7,10)
InChIKey
YUTDFIMDLUJOJK-UHFFFAOYSA-N
Compound name
N-methyl-1,6-diazabicyclo[3.1.0]hexane-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

141.09021 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.09749 134.8
[M+Na]+ 164.07943 144.1
[M-H]- 140.08293 136.2
[M+NH4]+ 159.12403 152.4
[M+K]+ 180.05337 141.3
[M+H-H2O]+ 124.08747 129.1
[M+HCOO]- 186.08841 154.1
[M+CH3COO]- 200.10406 175.3
[M+Na-2H]- 162.06488 141.4
[M]+ 141.08966 134.3
[M]- 141.09076 134.3
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