CID 43027

59436-69-0

Structural Information

Molecular Formula

C₁₀H₁₈N₂O₂

SMILES

CCOC(=O)N1C2CCC1CN(C2)C

InChI

InChI=1S/C10H18N2O2/c1-3-14-10(13)12-8-4-5-9(12)7-11(2)6-8/h8-9H,3-7H2,1-2H3

InChIKey

KBFADUFECIUFCN-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 198.13683 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]+	199.14411	146.2
[M+Na]+	221.12605	155.1
[M+NH4]+	216.17065	153.9
[M+K]+	237.09999	151.8
[M-H]-	197.12955	145.0
[M+Na-2H]-	219.11150	146.7
[M]+	198.13628	146.7
[M]-	198.13738	146.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe