CID 79465701

2287283-98-9

Structural Information

Molecular Formula

C₁₀H₂₁NO

SMILES

CC(C)COC1CCCC(C1)N

InChI

InChI=1S/C10H21NO/c1-8(2)7-12-10-5-3-4-9(11)6-10/h8-10H,3-7,11H2,1-2H3

InChIKey

YNEROHUTWQLYIH-UHFFFAOYSA-N

Compound name

3-(2-methylpropoxy)cyclohexan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 171.16231 Da
Monoisotopic Mass: 1.8
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]+	172.16959	140.9
[M+Na]+	194.15153	149.9
[M+NH4]+	189.19613	149.5
[M+K]+	210.12547	144.3
[M-H]-	170.15503	143.2
[M+Na-2H]-	192.13698	144.9
[M]+	171.16176	142.5
[M]-	171.16286	142.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.