CID 1514447

140695-85-8

Structural Information

Molecular Formula

C₁₁H₂₁NO₃

SMILES

CC(C)(C)OC(=O)N1CCC[C@H](C1)CO

InChI

InChI=1S/C11H21NO3/c1-11(2,3)15-10(14)12-6-4-5-9(7-12)8-13/h9,13H,4-8H2,1-3H3/t9-/m1/s1

InChIKey

OJCLHERKFHHUTB-SECBINFHSA-N

Compound name

tert-butyl (3R)-3-(hydroxymethyl)piperidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 2000
Patents: 215.15215 Da
Monoisotopic Mass: 1.2
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]+	216.15943	151.7
[M+Na]+	238.14137	156.3
[M-H]-	214.14487	151.8
[M+NH4]+	233.18597	168.5
[M+K]+	254.11531	155.5
[M+H-H2O]+	198.14941	145.8
[M+HCOO]-	260.15035	166.8
[M+CH3COO]-	274.16600	184.0
[M+Na-2H]-	236.12682	154.4
[M]+	215.15160	149.4
[M]-	215.15270	149.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe