CID 165639299

2229266-44-6

Structural Information

Molecular Formula
C15H27NO3
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)C2(CCC2)CO
InChI
InChI=1S/C15H27NO3/c1-14(2,3)19-13(18)16-9-5-12(6-10-16)15(11-17)7-4-8-15/h12,17H,4-11H2,1-3H3
InChIKey
LZMBMANVYRAYTJ-UHFFFAOYSA-N
Compound name
tert-butyl 4-[1-(hydroxymethyl)cyclobutyl]piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.1991 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.206376 167.0
[M+Na]+ 292.188318 168.9
[M-H]- 268.191824 169.5
[M+NH4]+ 287.232923 176.8
[M+K]+ 308.162258 170.6
[M+H-H2O]+ 252.196360 156.0
[M+HCOO]- 314.197301 179.1
[M+CH3COO]- 328.212951 196.9
[M+Na-2H]- 290.173766 168.3
[M]+ 269.19855142 172.2
[M]- 269.19964858 172.2
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.