CID 132396217

2172560-71-1

Structural Information

Molecular Formula
C15H25NO5
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)C2CCC(O2)C(=O)O
InChI
InChI=1S/C15H25NO5/c1-15(2,3)21-14(19)16-8-6-10(7-9-16)11-4-5-12(20-11)13(17)18/h10-12H,4-9H2,1-3H3,(H,17,18)
InChIKey
NFBUIHVVVXOVQE-UHFFFAOYSA-N
Compound name
5-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]oxolane-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.17328 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.180556 170.6
[M+Na]+ 322.162498 173.3
[M-H]- 298.166004 174.0
[M+NH4]+ 317.207103 183.9
[M+K]+ 338.136438 173.5
[M+H-H2O]+ 282.170540 164.4
[M+HCOO]- 344.171481 182.3
[M+CH3COO]- 358.187131 198.4
[M+Na-2H]- 320.147946 169.0
[M]+ 299.17273142 167.7
[M]- 299.17382858 167.7
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

No patent data available for this compound.