CID 10086969

N-methylazetidin-3-amine dihydrochloride

Structural Information

Molecular Formula
C4H10N2
SMILES
CNC1CNC1
InChI
InChI=1S/C4H10N2/c1-5-4-2-6-3-4/h4-6H,2-3H2,1H3
InChIKey
NQPTWMKTGPWPMX-UHFFFAOYSA-N
Compound name
N-methylazetidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

397
Patents

86.0844 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 87.091676 116.3
[M+Na]+ 109.07362 121.4
[M-H]- 85.077124 117.1
[M+NH4]+ 104.11822 131.2
[M+K]+ 125.04756 123.7
[M+H-H2O]+ 69.081660 105.6
[M+HCOO]- 131.08260 137.2
[M+CH3COO]- 145.09825 167.6
[M+Na-2H]- 107.05907 123.8
[M]+ 86.083851 120.5
[M]- 86.084949 120.5
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

patents stripe