CID 139026679

2361635-84-7

Structural Information

Molecular Formula

C₈H₁₅N

SMILES

C1CC2(C1)CCC2CN

InChI

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

InChIKey

BETZWHQPTWVESS-UHFFFAOYSA-N

Compound name

spiro[3.3]heptan-3-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 125.12045 Da
Monoisotopic Mass: 1.7
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	133.1
[M+Na]+	148.10967	133.9
[M+NH4]+	143.15427	135.8
[M+K]+	164.08361	130.5
[M-H]-	124.11317	130.9
[M+Na-2H]-	146.09512	134.6
[M]+	125.11990	130.4
[M]-	125.12100	130.4

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.