CID 115601

63990-41-0

Structural Information

Molecular Formula

C₁₀H₁₈N₂O

SMILES

CCC(=O)N1C2CCC1CN(C2)C

InChI

InChI=1S/C10H18N2O/c1-3-10(13)12-8-4-5-9(12)7-11(2)6-8/h8-9H,3-7H2,1-2H3

InChIKey

GEXXLNYKQLDCBQ-UHFFFAOYSA-N

Compound name

1-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)propan-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 182.1419 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]+	183.14918	143.0
[M+Na]+	205.13112	152.5
[M+NH4]+	200.17572	151.3
[M+K]+	221.10506	148.6
[M-H]-	181.13462	142.4
[M+Na-2H]-	203.11657	144.0
[M]+	182.14135	143.8
[M]-	182.14245	143.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe