CID 24160

Alpha-8-tert-butyl-2-(2-piperidyl)-1,4-dioxaspiro(4.5)decane hydrochloride

Structural Information

Molecular Formula
C17H31NO2
SMILES
CC(C)(C)C1CCC2(CC1)OCC(O2)C3CCCCN3
InChI
InChI=1S/C17H31NO2/c1-16(2,3)13-7-9-17(10-8-13)19-12-15(20-17)14-6-4-5-11-18-14/h13-15,18H,4-12H2,1-3H3
InChIKey
KZUOLAKBJHYWFA-UHFFFAOYSA-N
Compound name
2-(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

281.23547 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.24275 171.3
[M+Na]+ 304.22469 172.5
[M-H]- 280.22819 176.3
[M+NH4]+ 299.26929 186.0
[M+K]+ 320.19863 171.5
[M+H-H2O]+ 264.23273 164.4
[M+HCOO]- 326.23367 179.4
[M+CH3COO]- 340.24932 194.9
[M+Na-2H]- 302.21014 172.3
[M]+ 281.23492 161.8
[M]- 281.23602 161.8
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.