CID 90190338

3-cyclopropyl-5-(hydroxymethyl)oxazolidin-2-one

Structural Information

Molecular Formula
C7H11NO3
SMILES
C1CC1N2CC(OC2=O)CO
InChI
InChI=1S/C7H11NO3/c9-4-6-3-8(5-1-2-5)7(10)11-6/h5-6,9H,1-4H2
InChIKey
UREIIWHZFZIDNT-UHFFFAOYSA-N
Compound name
3-cyclopropyl-5-(hydroxymethyl)-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

157.0739 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.08118 133.0
[M+Na]+ 180.06312 142.7
[M-H]- 156.06662 138.7
[M+NH4]+ 175.10772 147.7
[M+K]+ 196.03706 141.0
[M+H-H2O]+ 140.07116 126.8
[M+HCOO]- 202.07210 153.1
[M+CH3COO]- 216.08775 175.8
[M+Na-2H]- 178.04857 137.3
[M]+ 157.07335 134.9
[M]- 157.07445 134.9
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