CID 132372767

2172538-03-1

Structural Information

Molecular Formula
C14H23NO5
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)(C2(CC2)C(=O)O)O
InChI
InChI=1S/C14H23NO5/c1-12(2,3)20-11(18)15-8-6-14(19,7-9-15)13(4-5-13)10(16)17/h19H,4-9H2,1-3H3,(H,16,17)
InChIKey
DZIFKQXTEVCPEC-UHFFFAOYSA-N
Compound name
1-[4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.15762 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.164896 168.1
[M+Na]+ 308.146838 174.2
[M-H]- 284.150344 171.0
[M+NH4]+ 303.191443 180.1
[M+K]+ 324.120778 173.4
[M+H-H2O]+ 268.154880 164.4
[M+HCOO]- 330.155821 180.1
[M+CH3COO]- 344.171471 195.7
[M+Na-2H]- 306.132286 171.1
[M]+ 285.15707142 169.3
[M]- 285.15816858 169.3
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.