CID 71744119

885269-69-2

Structural Information

Molecular Formula

C₁₁H₂₂N₂O₃

SMILES

CC(C)(C)OC(=O)NCC1(CCOCC1)N

InChI

InChI=1S/C11H22N2O3/c1-10(2,3)16-9(14)13-8-11(12)4-6-15-7-5-11/h4-8,12H2,1-3H3,(H,13,14)

InChIKey

OKKXSYCQUVNYBS-UHFFFAOYSA-N

Compound name

tert-butyl N-[(4-aminooxan-4-yl)methyl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
Patents: 230.16304 Da
Monoisotopic Mass: 0.2
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]+	231.17032	154.2
[M+Na]+	253.15226	160.6
[M+NH4]+	248.19686	161.7
[M+K]+	269.12620	155.9
[M-H]-	229.15576	155.9
[M+Na-2H]-	251.13771	157.9
[M]+	230.16249	155.3
[M]-	230.16359	155.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe