CID 202756

Ethyl 1-(2-piperidinopropionoxy)cyclopentane-1-carboxylate hydrochloride

Structural Information

Molecular Formula
C16H27NO4
SMILES
CCOC(=O)C1(CCCC1)OC(=O)C(C)N2CCCCC2
InChI
InChI=1S/C16H27NO4/c1-3-20-15(19)16(9-5-6-10-16)21-14(18)13(2)17-11-7-4-8-12-17/h13H,3-12H2,1-2H3
InChIKey
QYVRQICQISXSTC-UHFFFAOYSA-N
Compound name
ethyl 1-(2-piperidin-1-ylpropanoyloxy)cyclopentane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.194 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.20128 174.1
[M+Na]+ 320.18322 175.1
[M-H]- 296.18672 177.2
[M+NH4]+ 315.22782 190.5
[M+K]+ 336.15716 174.7
[M+H-H2O]+ 280.19126 166.8
[M+HCOO]- 342.19220 188.2
[M+CH3COO]- 356.20785 199.7
[M+Na-2H]- 318.16867 171.4
[M]+ 297.19345 170.6
[M]- 297.19455 170.6
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.