CID 10820794

202817-06-9

Structural Information

Molecular Formula

C₈H₁₃NO₂

SMILES

CC(C)(C)C1=CC(=NO1)CO

InChI

InChI=1S/C8H13NO2/c1-8(2,3)7-4-6(5-10)9-11-7/h4,10H,5H2,1-3H3

InChIKey

ZEWDREDIDBZTAP-UHFFFAOYSA-N

Compound name

(5-tert-butyl-1,2-oxazol-3-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 39
Patents: 155.09464 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]+	156.10192	132.3
[M+Na]+	178.08386	143.2
[M+NH4]+	173.12846	139.8
[M+K]+	194.05780	141.1
[M-H]-	154.08736	133.2
[M+Na-2H]-	176.06931	136.7
[M]+	155.09409	134.0
[M]-	155.09519	134.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe