CID 49548

67196-21-8

Structural Information

Molecular Formula

C₉H₁₆N₂O₂

SMILES

CN1CC2CCC(C1)N2C(=O)OC

InChI

InChI=1S/C9H16N2O2/c1-10-5-7-3-4-8(6-10)11(7)9(12)13-2/h7-8H,3-6H2,1-2H3

InChIKey

FEZVKEOPBBKYEP-UHFFFAOYSA-N

Compound name

methyl 3-methyl-3,8-diazabicyclo[3.2.1]octane-8-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 28
Patents: 184.12119 Da
Monoisotopic Mass: 0.6
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]+	185.12847	141.7
[M+Na]+	207.11041	150.9
[M+NH4]+	202.15501	149.6
[M+K]+	223.08435	147.8
[M-H]-	183.11391	140.6
[M+Na-2H]-	205.09586	142.5
[M]+	184.12064	142.3
[M]-	184.12174	142.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe