CID 105525265

1251032-53-7

Structural Information

Molecular Formula
C14H25NO5
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)(C(C)(C)C(=O)O)O
InChI
InChI=1S/C14H25NO5/c1-12(2,3)20-11(18)15-8-6-14(19,7-9-15)13(4,5)10(16)17/h19H,6-9H2,1-5H3,(H,16,17)
InChIKey
NUJXHFXAZXQBFA-UHFFFAOYSA-N
Compound name
2-[4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]-2-methylpropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.17328 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.18056 166.2
[M+Na]+ 310.16250 170.2
[M-H]- 286.16600 165.0
[M+NH4]+ 305.20710 181.2
[M+K]+ 326.13644 170.1
[M+H-H2O]+ 270.17054 162.1
[M+HCOO]- 332.17148 176.9
[M+CH3COO]- 346.18713 195.0
[M+Na-2H]- 308.14795 169.0
[M]+ 287.17273 164.8
[M]- 287.17383 164.8
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.