CID 18526034

937601-51-9

Structural Information

Molecular Formula
C15H24N2O5
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)N2CC(CC2=O)C(=O)O
InChI
InChI=1S/C15H24N2O5/c1-15(2,3)22-14(21)16-6-4-11(5-7-16)17-9-10(13(19)20)8-12(17)18/h10-11H,4-9H2,1-3H3,(H,19,20)
InChIKey
KEMNWHGXIQXFNZ-UHFFFAOYSA-N
Compound name
1-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-5-oxopyrrolidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

312.16852 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.17580 173.3
[M+Na]+ 335.15774 176.9
[M-H]- 311.16124 175.1
[M+NH4]+ 330.20234 186.1
[M+K]+ 351.13168 175.7
[M+H-H2O]+ 295.16578 166.3
[M+HCOO]- 357.16672 184.7
[M+CH3COO]- 371.18237 201.5
[M+Na-2H]- 333.14319 170.2
[M]+ 312.16797 169.9
[M]- 312.16907 169.9
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