CID 55281159

2306262-39-3

Structural Information

Molecular Formula
C5H13N3
SMILES
C1C(CN1)(CN)CN
InChI
InChI=1S/C5H13N3/c6-1-5(2-7)3-8-4-5/h8H,1-4,6-7H2
InChIKey
MGHSXBVGEHKQCR-UHFFFAOYSA-N
Compound name
[3-(aminomethyl)azetidin-3-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

115.11095 Da
Monoisotopic Mass

-2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.11823 128.8
[M+Na]+ 138.10017 133.2
[M-H]- 114.10367 128.6
[M+NH4]+ 133.14477 143.5
[M+K]+ 154.07411 134.6
[M+H-H2O]+ 98.108210 118.1
[M+HCOO]- 160.10915 148.9
[M+CH3COO]- 174.12480 173.7
[M+Na-2H]- 136.08562 134.5
[M]+ 115.11040 130.7
[M]- 115.11150 130.7
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

No patent data available for this compound.