CID 21614503

1-methyl-3-azabicyclo[3.1.0]hexane hydrochloride

Structural Information

Molecular Formula

C₆H₁₁N

SMILES

CC12CC1CNC2

InChI

InChI=1S/C6H11N/c1-6-2-5(6)3-7-4-6/h5,7H,2-4H2,1H3

InChIKey

DHAYFFGRLUYHGO-UHFFFAOYSA-N

Compound name

1-methyl-3-azabicyclo[3.1.0]hexane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 46
Patents: 97.08915 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]+	98.096426	122.1
[M+Na]+	120.07837	133.9
[M+NH4]+	115.12297	133.7
[M+K]+	136.05231	129.3
[M-H]-	96.081874	130.0
[M+Na-2H]-	118.06382	130.3
[M]+	97.088601	127.2
[M]-	97.089699	127.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe