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]+ 298.201276 174.1
[M+Na]+ 320.183218 175.1
[M-H]- 296.186724 177.2
[M+NH4]+ 315.227823 190.5
[M+K]+ 336.157158 174.7
[M+H-H2O]+ 280.191260 166.8
[M+HCOO]- 342.192201 188.2
[M+CH3COO]- 356.207851 199.7
[M+Na-2H]- 318.168666 171.4
[M]+ 297.19345142 170.6
[M]- 297.19454858 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.