CID 53485540

Spiro[2.5]octan-6-amine hydrochloride

Structural Information

Molecular Formula

C₈H₁₅N

SMILES

C1CC2(CCC1N)CC2

InChI

InChI=1S/C8H15N/c9-7-1-3-8(4-2-7)5-6-8/h7H,1-6,9H2

InChIKey

XKPDOWURXRJLMO-UHFFFAOYSA-N

Compound name

spiro[2.5]octan-6-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 126
Patents: 125.12045 Da
Monoisotopic Mass: 1.5
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]+	126.12773	126.6
[M+Na]+	148.10967	134.0
[M-H]-	124.11317	132.5
[M+NH4]+	143.15427	145.6
[M+K]+	164.08361	132.6
[M+H-H2O]+	108.11771	121.5
[M+HCOO]-	170.11865	147.7
[M+CH3COO]-	184.13430	175.6
[M+Na-2H]-	146.09512	133.8
[M]+	125.11990	122.7
[M]-	125.12100	122.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe