CID 20781120

1-methyl-7-azabicyclo[2.2.1]heptane hydrochloride

Structural Information

Molecular Formula

C₇H₁₃N

SMILES

CC12CCC(N1)CC2

InChI

InChI=1S/C7H13N/c1-7-4-2-6(8-7)3-5-7/h6,8H,2-5H2,1H3

InChIKey

AUZBWYMMZWGCIS-UHFFFAOYSA-N

Compound name

1-methyl-7-azabicyclo[2.2.1]heptane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 76
Patents: 111.1048 Da
Monoisotopic Mass: 1.1
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]+	112.11208	124.4
[M+Na]+	134.09402	133.2
[M+NH4]+	129.13862	135.8
[M+K]+	150.06796	128.9
[M-H]-	110.09752	124.4
[M+Na-2H]-	132.07947	128.0
[M]+	111.10425	125.5
[M]-	111.10535	125.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe