CID 62390559

2-hydroxy-2-(oxan-4-yl)acetamide

Structural Information

Molecular Formula
C7H13NO3
SMILES
C1COCCC1C(C(=O)N)O
InChI
InChI=1S/C7H13NO3/c8-7(10)6(9)5-1-3-11-4-2-5/h5-6,9H,1-4H2,(H2,8,10)
InChIKey
KOEHHYFUIVEIQO-UHFFFAOYSA-N
Compound name
2-hydroxy-2-(oxan-4-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

159.08954 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.096816 134.6
[M+Na]+ 182.078758 138.2
[M-H]- 158.082264 136.1
[M+NH4]+ 177.123363 152.3
[M+K]+ 198.052698 138.9
[M+H-H2O]+ 142.086800 128.9
[M+HCOO]- 204.087741 152.3
[M+CH3COO]- 218.103391 175.1
[M+Na-2H]- 180.064206 138.0
[M]+ 159.08899142 128.8
[M]- 159.09008858 128.8
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