CID 9833923

3-oxetanamine

Structural Information

Molecular Formula
C3H7NO
SMILES
C1C(CO1)N
InChI
InChI=1S/C3H7NO/c4-3-1-5-2-3/h3H,1-2,4H2
InChIKey
OJEOJUQOECNDND-UHFFFAOYSA-N
Compound name
oxetan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4460
Patents

73.052765 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 74.060041 107.3
[M+Na]+ 96.041983 113.2
[M-H]- 72.045489 111.3
[M+NH4]+ 91.086588 123.3
[M+K]+ 112.01592 117.7
[M+H-H2O]+ 56.050025 97.6
[M+HCOO]- 118.05097 130.1
[M+CH3COO]- 132.06662 165.8
[M+Na-2H]- 94.027431 116.2
[M]+ 73.052216 113.5
[M]- 73.053314 113.5
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