CID 9922512

84793-24-8

Structural Information

Molecular Formula
C16H19NO5
SMILES
CCOC(=O)[C@H](CCC1=CC=CC=C1)N2[C@H](C(=O)OC2=O)C
InChI
InChI=1S/C16H19NO5/c1-3-21-15(19)13(10-9-12-7-5-4-6-8-12)17-11(2)14(18)22-16(17)20/h4-8,11,13H,3,9-10H2,1-2H3/t11-,13-/m0/s1
InChIKey
GFZFELCFSBCPDB-AAEUAGOBSA-N
Compound name
ethyl (2S)-2-[(4S)-4-methyl-2,5-dioxo-1,3-oxazolidin-3-yl]-4-phenylbutanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

119
Patents

305.1263 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.13358 170.1
[M+Na]+ 328.11552 180.0
[M+NH4]+ 323.16012 175.1
[M+K]+ 344.08946 177.9
[M-H]- 304.11902 171.7
[M+Na-2H]- 326.10097 172.7
[M]+ 305.12575 171.6
[M]- 305.12685 171.6
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