CID 55291492

Spiro[3.4]octan-5-amine

Structural Information

Molecular Formula

C₈H₁₅N

SMILES

C1CC(C2(C1)CCC2)N

InChI

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

InChIKey

AFVGEZKLIAMPGH-UHFFFAOYSA-N

Compound name

spiro[3.4]octan-8-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 125.12045 Da
Monoisotopic Mass: 1.3
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	127.9
[M+Na]+	148.10967	132.4
[M+NH4]+	143.15427	135.2
[M+K]+	164.08361	128.4
[M-H]-	124.11317	128.2
[M+Na-2H]-	146.09512	131.7
[M]+	125.11990	127.4
[M]-	125.12100	127.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe