CID 84731051

N-methylbicyclo[3.1.0]hexan-6-amine hydrochloride

Structural Information

Molecular Formula

C₇H₁₃N

SMILES

CNC1C2C1CCC2

InChI

InChI=1S/C7H13N/c1-8-7-5-3-2-4-6(5)7/h5-8H,2-4H2,1H3

InChIKey

SFSMMUPBCGDAKQ-UHFFFAOYSA-N

Compound name

N-methylbicyclo[3.1.0]hexan-6-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 111.1048 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]+	112.112076	121.0
[M+Na]+	134.094018	130.3
[M-H]-	110.097524	126.4
[M+NH4]+	129.138623	141.6
[M+K]+	150.067958	127.7
[M+H-H2O]+	94.102060	115.9
[M+HCOO]-	156.103001	144.7
[M+CH3COO]-	170.118651	175.8
[M+Na-2H]-	132.079466	127.8
[M]+	111.10425142	121.5
[M]-	111.10534858	121.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe