CID 132343713

2137794-33-1

Structural Information

Molecular Formula
C15H25NO5
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)[C@H]2[C@@H](CCO2)C(=O)O
InChI
InChI=1S/C15H25NO5/c1-15(2,3)21-14(19)16-7-4-10(5-8-16)12-11(13(17)18)6-9-20-12/h10-12H,4-9H2,1-3H3,(H,17,18)/t11-,12+/m1/s1
InChIKey
ABRSPSOJEDIUMI-NEPJUHHUSA-N
Compound name
(2S,3R)-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]oxolane-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.17328 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.18056 170.6
[M+Na]+ 322.16250 173.3
[M-H]- 298.16600 174.0
[M+NH4]+ 317.20710 183.9
[M+K]+ 338.13644 173.5
[M+H-H2O]+ 282.17054 164.4
[M+HCOO]- 344.17148 182.3
[M+CH3COO]- 358.18713 198.4
[M+Na-2H]- 320.14795 169.0
[M]+ 299.17273 167.7
[M]- 299.17383 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.