CID 144198

2,6-di-tert-butylpiperidine

Structural Information

Molecular Formula

C₁₃H₂₇N

SMILES

CC(C)(C)C1CCCC(N1)C(C)(C)C

InChI

InChI=1S/C13H27N/c1-12(2,3)10-8-7-9-11(14-10)13(4,5)6/h10-11,14H,7-9H2,1-6H3

InChIKey

ZOYHTWUFFGGARK-UHFFFAOYSA-N

Compound name

2,6-ditert-butylpiperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1075
Patents: 197.21436 Da
Monoisotopic Mass: 4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	198.221636	151.9
[M+Na]+	220.203578	156.2
[M-H]-	196.207084	151.9
[M+NH4]+	215.248183	169.8
[M+K]+	236.177518	154.0
[M+H-H2O]+	180.211620	146.8
[M+HCOO]-	242.212561	164.9
[M+CH3COO]-	256.228211	185.2
[M+Na-2H]-	218.189026	155.4
[M]+	197.21381142	146.9
[M]-	197.21490858	146.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe