CID 84020529

2-(azetidin-1-yl)propan-1-amine

Structural Information

Molecular Formula
C6H14N2
SMILES
CC(CN)N1CCC1
InChI
InChI=1S/C6H14N2/c1-6(5-7)8-3-2-4-8/h6H,2-5,7H2,1H3
InChIKey
JRZFLGYOIRLVTR-UHFFFAOYSA-N
Compound name
2-(azetidin-1-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

114.1157 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.12298 127.0
[M+Na]+ 137.10492 131.4
[M-H]- 113.10842 128.4
[M+NH4]+ 132.14952 141.2
[M+K]+ 153.07886 134.2
[M+H-H2O]+ 97.112960 115.6
[M+HCOO]- 159.11390 147.1
[M+CH3COO]- 173.12955 176.3
[M+Na-2H]- 135.09037 131.6
[M]+ 114.11515 132.1
[M]- 114.11625 132.1
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