CID 66357626

3-(tert-butoxy)-2,2-dimethylcyclobutan-1-amine

Structural Information

Molecular Formula

C₁₀H₂₁NO

SMILES

CC1(C(CC1OC(C)(C)C)N)C

InChI

InChI=1S/C10H21NO/c1-9(2,3)12-8-6-7(11)10(8,4)5/h7-8H,6,11H2,1-5H3

InChIKey

XBYKLHIJRIEJOA-UHFFFAOYSA-N

Compound name

2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 171.16231 Da
Monoisotopic Mass: 1.6
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]+	172.169586	142.7
[M+Na]+	194.151528	148.7
[M-H]-	170.155034	146.2
[M+NH4]+	189.196133	158.8
[M+K]+	210.125468	151.0
[M+H-H2O]+	154.159570	134.3
[M+HCOO]-	216.160511	162.4
[M+CH3COO]-	230.176161	188.1
[M+Na-2H]-	192.136976	146.8
[M]+	171.16176142	151.2
[M]-	171.16285858	151.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.