CID 10566995

143564-89-0

Structural Information

Molecular Formula
C18H17NO4
SMILES
C[C@@H]1C(=O)O[C@@H](N1C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C18H17NO4/c1-13-17(20)23-16(15-10-6-3-7-11-15)19(13)18(21)22-12-14-8-4-2-5-9-14/h2-11,13,16H,12H2,1H3/t13-,16-/m1/s1
InChIKey
USPAXEIEXNCGOJ-CZUORRHYSA-N
Compound name
benzyl (2R,4R)-4-methyl-5-oxo-2-phenyl-1,3-oxazolidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

311.11575 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.12303 171.4
[M+Na]+ 334.10497 178.4
[M-H]- 310.10847 180.7
[M+NH4]+ 329.14957 184.8
[M+K]+ 350.07891 176.1
[M+H-H2O]+ 294.11301 162.7
[M+HCOO]- 356.11395 191.7
[M+CH3COO]- 370.12960 202.9
[M+Na-2H]- 332.09042 172.6
[M]+ 311.11520 173.0
[M]- 311.11630 173.0
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

No patent data available for this compound.