CID 14456877

1217272-20-2

Structural Information

Molecular Formula
C5H9NO3
SMILES
CN1C(COC1=O)CO
InChI
InChI=1S/C5H9NO3/c1-6-4(2-7)3-9-5(6)8/h4,7H,2-3H2,1H3
InChIKey
UWUDQTYKCUFKDR-UHFFFAOYSA-N
Compound name
4-(hydroxymethyl)-3-methyl-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

131.05824 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.06552 123.4
[M+Na]+ 154.04746 132.0
[M-H]- 130.05096 125.2
[M+NH4]+ 149.09206 144.1
[M+K]+ 170.02140 132.5
[M+H-H2O]+ 114.05550 118.4
[M+HCOO]- 176.05644 144.2
[M+CH3COO]- 190.07209 167.5
[M+Na-2H]- 152.03291 128.6
[M]+ 131.05769 123.3
[M]- 131.05879 123.3
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