CID 55296078

3-hydroxyoxetane-3-carboxamide

Structural Information

Molecular Formula
C4H7NO3
SMILES
C1C(CO1)(C(=O)N)O
InChI
InChI=1S/C4H7NO3/c5-3(6)4(7)1-8-2-4/h7H,1-2H2,(H2,5,6)
InChIKey
KVKRRVJMKMVPTA-UHFFFAOYSA-N
Compound name
3-hydroxyoxetane-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

117.042595 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.04987 120.8
[M+Na]+ 140.03181 126.2
[M-H]- 116.03532 123.5
[M+NH4]+ 135.07642 135.9
[M+K]+ 156.00575 130.5
[M+H-H2O]+ 100.03986 111.7
[M+HCOO]- 162.04080 141.2
[M+CH3COO]- 176.05645 169.9
[M+Na-2H]- 138.01726 128.0
[M]+ 117.04205 127.2
[M]- 117.04314 127.2
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