CID 736817

144222-22-0

Structural Information

Molecular Formula

C₁₁H₂₂N₂O₂

SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CN

InChI

InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-6-4-9(8-12)5-7-13/h9H,4-8,12H2,1-3H3

InChIKey

KLKBCNDBOVRQIJ-UHFFFAOYSA-N

Compound name

tert-butyl 4-(aminomethyl)piperidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3826
Patents: 214.16812 Da
Monoisotopic Mass: 0.9
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]+	215.17540	151.5
[M+Na]+	237.15734	159.3
[M+NH4]+	232.20194	157.9
[M+K]+	253.13128	155.4
[M-H]-	213.16084	151.3
[M+Na-2H]-	235.14279	154.1
[M]+	214.16757	152.2
[M]-	214.16867	152.2

Literature stripe

literature stripe

Patent stripe

patents stripe