CID 65008723

1528564-50-2

Structural Information

Molecular Formula

C₇H₁₃N

SMILES

C1CC12CC(C2)CN

InChI

InChI=1S/C7H13N/c8-5-6-3-7(4-6)1-2-7/h6H,1-5,8H2

InChIKey

NOQWDJRJSISPHH-UHFFFAOYSA-N

Compound name

spiro[2.3]hexan-5-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 111.1048 Da
Monoisotopic Mass: 1.0
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	123.4
[M+Na]+	134.09402	130.9
[M+NH4]+	129.13862	131.2
[M+K]+	150.06796	126.8
[M-H]-	110.09752	130.5
[M+Na-2H]-	132.07947	130.8
[M]+	111.10425	126.5
[M]-	111.10535	126.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe