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
2
Annotation Hits

0
References

42
Patents

243.11067 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.117946 152.4
[M+Na]+ 266.099888 159.8
[M-H]- 242.103394 155.3
[M+NH4]+ 261.144493 169.3
[M+K]+ 282.073828 160.5
[M+H-H2O]+ 226.107930 146.7
[M+HCOO]- 288.108871 171.6
[M+CH3COO]- 302.124521 193.2
[M+Na-2H]- 264.085336 152.2
[M]+ 243.11012142 157.0
[M]- 243.11121858 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