CID 117988834

Benzyl 1,2-oxazolidine-2-carboxylate

Structural Information

Molecular Formula
C11H13NO3
SMILES
C1CN(OC1)C(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C11H13NO3/c13-11(12-7-4-8-15-12)14-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2
InChIKey
UQYSDTFTMIJZTO-UHFFFAOYSA-N
Compound name
benzyl 1,2-oxazolidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

207.08954 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.096816 144.4
[M+Na]+ 230.078758 150.2
[M-H]- 206.082264 149.8
[M+NH4]+ 225.123363 161.8
[M+K]+ 246.052698 150.0
[M+H-H2O]+ 190.086800 136.9
[M+HCOO]- 252.087741 165.3
[M+CH3COO]- 266.103391 181.0
[M+Na-2H]- 228.064206 149.1
[M]+ 207.08899142 144.2
[M]- 207.09008858 144.2
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