CID 98717

Tert-butylamine, n-(2-oxazolin-2-yl)-

Structural Information

Molecular Formula

C₇H₁₄N₂O

SMILES

CC(C)(C)NC1=NCCO1

InChI

InChI=1S/C7H14N2O/c1-7(2,3)9-6-8-4-5-10-6/h4-5H2,1-3H3,(H,8,9)

InChIKey

XTFUOJXHSBBAFT-UHFFFAOYSA-N

Compound name

N-tert-butyl-4,5-dihydro-1,3-oxazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 142.11061 Da
Monoisotopic Mass: 0.6
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]+	143.11789	130.7
[M+Na]+	165.09983	140.2
[M+NH4]+	160.14443	138.6
[M+K]+	181.07377	137.8
[M-H]-	141.10333	132.5
[M+Na-2H]-	163.08528	135.3
[M]+	142.11006	132.4
[M]-	142.11116	132.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe