CID 58902776

3-methylidene-8-azabicyclo[3.2.1]octane hydrochloride

Structural Information

Molecular Formula

C₈H₁₃N

SMILES

C=C1CC2CCC(C1)N2

InChI

InChI=1S/C8H13N/c1-6-4-7-2-3-8(5-6)9-7/h7-9H,1-5H2

InChIKey

MXQPENUGELTBFF-UHFFFAOYSA-N

Compound name

3-methylidene-8-azabicyclo[3.2.1]octane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 123.1048 Da
Monoisotopic Mass: 1.2
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]+	124.11208	126.8
[M+Na]+	146.09402	136.8
[M+NH4]+	141.13862	136.6
[M+K]+	162.06796	131.9
[M-H]-	122.09752	127.3
[M+Na-2H]-	144.07947	129.3
[M]+	123.10425	128.1
[M]-	123.10535	128.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe