CID 62225834

4-hydroxyoxane-4-carboxamide

Structural Information

Molecular Formula
C6H11NO3
SMILES
C1COCCC1(C(=O)N)O
InChI
InChI=1S/C6H11NO3/c7-5(8)6(9)1-3-10-4-2-6/h9H,1-4H2,(H2,7,8)
InChIKey
QQEWNVXINVYCDE-UHFFFAOYSA-N
Compound name
4-hydroxyoxane-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

145.0739 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.081176 129.2
[M+Na]+ 168.063118 134.4
[M-H]- 144.066624 131.2
[M+NH4]+ 163.107723 149.5
[M+K]+ 184.037058 135.1
[M+H-H2O]+ 128.071160 124.6
[M+HCOO]- 190.072101 148.1
[M+CH3COO]- 204.087751 170.6
[M+Na-2H]- 166.048566 135.6
[M]+ 145.07335142 124.0
[M]- 145.07444858 124.0
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