CID 12706150

Bicyclo[2.2.0]hexan-1-amine hydrochloride

Structural Information

Molecular Formula

C₆H₁₁N

SMILES

C1CC2(C1CC2)N

InChI

InChI=1S/C6H11N/c7-6-3-1-5(6)2-4-6/h5H,1-4,7H2

InChIKey

XZJJBJBMECLLKV-UHFFFAOYSA-N

Compound name

bicyclo[2.2.0]hexan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 97.08915 Da
Monoisotopic Mass: 0.4
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	116.0
[M+Na]+	120.07837	121.0
[M-H]-	96.081874	120.3
[M+NH4]+	115.12297	128.0
[M+K]+	136.05231	125.5
[M+H-H2O]+	80.086410	103.7
[M+HCOO]-	142.08735	135.4
[M+CH3COO]-	156.10300	182.5
[M+Na-2H]-	118.06382	123.9
[M]+	97.088601	129.4
[M]-	97.089699	129.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe