CID 11276570

Ethyl (2s)-2-[(4s)-4-methyl-2,5-dioxo-1,3-oxazolidin-3-yl]pentanoate

Structural Information

Molecular Formula
C11H17NO5
SMILES
CCC[C@@H](C(=O)OCC)N1[C@H](C(=O)OC1=O)C
InChI
InChI=1S/C11H17NO5/c1-4-6-8(10(14)16-5-2)12-7(3)9(13)17-11(12)15/h7-8H,4-6H2,1-3H3/t7-,8-/m0/s1
InChIKey
XTLCJZYMZHGJLY-YUMQZZPRSA-N
Compound name
ethyl (2S)-2-[(4S)-4-methyl-2,5-dioxo-1,3-oxazolidin-3-yl]pentanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

243.11067 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.11795 152.4
[M+Na]+ 266.09989 159.8
[M-H]- 242.10339 155.3
[M+NH4]+ 261.14449 169.3
[M+K]+ 282.07383 160.5
[M+H-H2O]+ 226.10793 146.7
[M+HCOO]- 288.10887 171.6
[M+CH3COO]- 302.12452 193.2
[M+Na-2H]- 264.08534 152.2
[M]+ 243.11012 157.0
[M]- 243.11122 157.0
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

patents stripe