CID 132364519

2155855-90-4

Structural Information

Molecular Formula
C15H25NO5
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)(C2(CCC2)C(=O)O)O
InChI
InChI=1S/C15H25NO5/c1-13(2,3)21-12(19)16-9-5-8-15(20,10-16)14(11(17)18)6-4-7-14/h20H,4-10H2,1-3H3,(H,17,18)
InChIKey
HRJCIEFJXLSHGT-UHFFFAOYSA-N
Compound name
1-[3-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]cyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.17328 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.18056 174.0
[M+Na]+ 322.16250 175.8
[M-H]- 298.16600 175.4
[M+NH4]+ 317.20710 183.4
[M+K]+ 338.13644 178.2
[M+H-H2O]+ 282.17054 164.5
[M+HCOO]- 344.17148 183.9
[M+CH3COO]- 358.18713 198.5
[M+Na-2H]- 320.14795 175.1
[M]+ 299.17273 179.3
[M]- 299.17383 179.3
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.