CID 136093

7-azabicyclo[2.2.1]heptane hydrochloride

Structural Information

Molecular Formula

C₆H₁₁N

SMILES

C1CC2CCC1N2

InChI

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

InChIKey

SNZSSCZJMVIOCR-UHFFFAOYSA-N

Compound name

7-azabicyclo[2.2.1]heptane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 27
References: 4845
Patents: 97.08915 Da
Monoisotopic Mass: 0.9
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	119.4
[M+Na]+	120.07837	128.2
[M+NH4]+	115.12297	129.5
[M+K]+	136.05231	125.9
[M-H]-	96.081874	119.4
[M+Na-2H]-	118.06382	121.7
[M]+	97.088601	120.3
[M]-	97.089699	120.3

Literature stripe

literature stripe

Patent stripe

patents stripe