CID 24168

Beta-6-ethyl-2-(2-piperidyl)-1,4-dioxaspiro(4.5)decane hydrochloride

Structural Information

Molecular Formula
C15H27NO2
SMILES
CCC1CCCCC12OCC(O2)C3CCCCN3
InChI
InChI=1S/C15H27NO2/c1-2-12-7-3-5-9-15(12)17-11-14(18-15)13-8-4-6-10-16-13/h12-14,16H,2-11H2,1H3
InChIKey
ONKIQPVKCWSGDK-UHFFFAOYSA-N
Compound name
2-(6-ethyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

253.20418 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.21146 163.3
[M+Na]+ 276.19340 164.8
[M-H]- 252.19690 168.3
[M+NH4]+ 271.23800 178.9
[M+K]+ 292.16734 163.7
[M+H-H2O]+ 236.20144 155.8
[M+HCOO]- 298.20238 173.6
[M+CH3COO]- 312.21803 172.2
[M+Na-2H]- 274.17885 164.1
[M]+ 253.20363 153.6
[M]- 253.20473 153.6
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.