CID 20770676

Methyl 4-(dimethylamino)piperidine-1-carboxylate

Structural Information

Molecular Formula

C₉H₁₈N₂O₂

SMILES

CN(C)C1CCN(CC1)C(=O)OC

InChI

InChI=1S/C9H18N2O2/c1-10(2)8-4-6-11(7-5-8)9(12)13-3/h8H,4-7H2,1-3H3

InChIKey

LXMSQHPKIUYDGT-UHFFFAOYSA-N

Compound name

methyl 4-(dimethylamino)piperidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 186.13683 Da
Monoisotopic Mass: 0.7
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]+	187.14411	142.7
[M+Na]+	209.12605	147.4
[M-H]-	185.12955	145.6
[M+NH4]+	204.17065	161.5
[M+K]+	225.09999	148.4
[M+H-H2O]+	169.13409	135.7
[M+HCOO]-	231.13503	162.8
[M+CH3COO]-	245.15068	187.2
[M+Na-2H]-	207.11150	145.6
[M]+	186.13628	141.1
[M]-	186.13738	141.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe