CID 55295500

3-(methylamino)azetidine-3-carboxamide hydrochloride

Structural Information

Molecular Formula
C5H11N3O
SMILES
CNC1(CNC1)C(=O)N
InChI
InChI=1S/C5H11N3O/c1-7-5(4(6)9)2-8-3-5/h7-8H,2-3H2,1H3,(H2,6,9)
InChIKey
CGXGLNOZJADLOB-UHFFFAOYSA-N
Compound name
3-(methylamino)azetidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

129.09021 Da
Monoisotopic Mass

-2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.097486 131.8
[M+Na]+ 152.079428 136.0
[M-H]- 128.082934 132.1
[M+NH4]+ 147.124033 145.9
[M+K]+ 168.053368 138.2
[M+H-H2O]+ 112.087470 121.0
[M+HCOO]- 174.088411 151.8
[M+CH3COO]- 188.104061 176.3
[M+Na-2H]- 150.064876 137.1
[M]+ 129.08966142 134.7
[M]- 129.09075858 134.7
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