CID 82593752

3-(1-methylazetidin-3-yl)propan-1-amine

Structural Information

Molecular Formula
C7H16N2
SMILES
CN1CC(C1)CCCN
InChI
InChI=1S/C7H16N2/c1-9-5-7(6-9)3-2-4-8/h7H,2-6,8H2,1H3
InChIKey
VJKITLMBBJGAKO-UHFFFAOYSA-N
Compound name
3-(1-methylazetidin-3-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

128.13135 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.13863 129.9
[M+Na]+ 151.12057 135.1
[M-H]- 127.12407 131.4
[M+NH4]+ 146.16517 144.0
[M+K]+ 167.09451 137.2
[M+H-H2O]+ 111.12861 118.6
[M+HCOO]- 173.12955 150.7
[M+CH3COO]- 187.14520 179.5
[M+Na-2H]- 149.10602 134.6
[M]+ 128.13080 136.4
[M]- 128.13190 136.4
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.