CID 18423490

358625-61-3

Structural Information

Molecular Formula
C14H27NO3
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)CC(C)(C)O
InChI
InChI=1S/C14H27NO3/c1-13(2,3)18-12(16)15-8-6-11(7-9-15)10-14(4,5)17/h11,17H,6-10H2,1-5H3
InChIKey
XYFOCNORIMHJLO-UHFFFAOYSA-N
Compound name
tert-butyl 4-(2-hydroxy-2-methylpropyl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

257.1991 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.20638 163.9
[M+Na]+ 280.18832 167.7
[M-H]- 256.19182 163.8
[M+NH4]+ 275.23292 179.2
[M+K]+ 296.16226 166.8
[M+H-H2O]+ 240.19636 158.4
[M+HCOO]- 302.19730 176.5
[M+CH3COO]- 316.21295 193.6
[M+Na-2H]- 278.17377 166.2
[M]+ 257.19855 162.3
[M]- 257.19965 162.3
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

patents stripe