CID 17941489

229003-15-0

Structural Information

Molecular Formula

C₆H₁₀N₂O

SMILES

CC(C)C1=COC(=N1)N

InChI

InChI=1S/C6H10N2O/c1-4(2)5-3-9-6(7)8-5/h3-4H,1-2H3,(H2,7,8)

InChIKey

WIOHEPKTAHGOHM-UHFFFAOYSA-N

Compound name

4-propan-2-yl-1,3-oxazol-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 31
Patents: 126.079315 Da
Monoisotopic Mass: 1.2
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]+	127.08659	124.6
[M+Na]+	149.06853	135.3
[M+NH4]+	144.11314	132.7
[M+K]+	165.04247	132.9
[M-H]-	125.07204	127.0
[M+Na-2H]-	147.05398	129.5
[M]+	126.07877	126.6
[M]-	126.07986	126.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe