CID 143092

Azetidin-1-amine dihydrochloride

Structural Information

Molecular Formula
C3H8N2
SMILES
C1CN(C1)N
InChI
InChI=1S/C3H8N2/c4-5-2-1-3-5/h1-4H2
InChIKey
BDIIXJCOXLQTKD-UHFFFAOYSA-N
Compound name
azetidin-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1186
Patents

72.06875 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 73.076026 110.9
[M+Na]+ 95.057968 116.9
[M-H]- 71.061474 112.7
[M+NH4]+ 90.102573 126.8
[M+K]+ 111.03191 120.0
[M+H-H2O]+ 55.066010 100.2
[M+HCOO]- 117.06695 133.0
[M+CH3COO]- 131.08260 166.6
[M+Na-2H]- 93.043416 118.5
[M]+ 72.068201 115.6
[M]- 72.069299 115.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe