CID 89725034

2260931-43-7

Structural Information

Molecular Formula

C₁₂H₂₄N₂O₂

SMILES

CC1CNCC(C1NC(=O)OC(C)(C)C)C

InChI

InChI=1S/C12H24N2O2/c1-8-6-13-7-9(2)10(8)14-11(15)16-12(3,4)5/h8-10,13H,6-7H2,1-5H3,(H,14,15)

InChIKey

BQMDYVTYDQVROM-UHFFFAOYSA-N

Compound name

tert-butyl N-(3,5-dimethylpiperidin-4-yl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 228.18378 Da
Monoisotopic Mass: 1.9
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]+	229.19106	157.1
[M+Na]+	251.17300	161.4
[M-H]-	227.17650	157.3
[M+NH4]+	246.21760	173.3
[M+K]+	267.14694	159.8
[M+H-H2O]+	211.18104	151.0
[M+HCOO]-	273.18198	172.6
[M+CH3COO]-	287.19763	191.2
[M+Na-2H]-	249.15845	158.7
[M]+	228.18323	153.3
[M]-	228.18433	153.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe