CID 22789944

37755-50-3

Structural Information

Molecular Formula
C11H17NO5
SMILES
CC(C)C[C@H](C(=O)O)OC(=O)[C@@H]1CCC(=O)N1
InChI
InChI=1S/C11H17NO5/c1-6(2)5-8(10(14)15)17-11(16)7-3-4-9(13)12-7/h6-8H,3-5H2,1-2H3,(H,12,13)(H,14,15)/t7-,8+/m0/s1
InChIKey
BLRNKJDBDKWEAL-JGVFFNPUSA-N
Compound name
(2R)-4-methyl-2-[(2S)-5-oxopyrrolidine-2-carbonyl]oxypentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

243.11067 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.117946 155.4
[M+Na]+ 266.099888 159.4
[M-H]- 242.103394 154.2
[M+NH4]+ 261.144493 171.3
[M+K]+ 282.073828 158.7
[M+H-H2O]+ 226.107930 149.5
[M+HCOO]- 288.108871 170.4
[M+CH3COO]- 302.124521 187.6
[M+Na-2H]- 264.085336 152.1
[M]+ 243.11012142 153.5
[M]- 243.11121858 153.5
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