CID 64387553

3-(4-methyl-1,3-oxazol-2-yl)aniline

Structural Information

Molecular Formula

C₁₀H₁₀N₂O

SMILES

CC1=COC(=N1)C2=CC(=CC=C2)N

InChI

InChI=1S/C10H10N2O/c1-7-6-13-10(12-7)8-3-2-4-9(11)5-8/h2-6H,11H2,1H3

InChIKey

LSVNEULSHINZKC-UHFFFAOYSA-N

Compound name

3-(4-methyl-1,3-oxazol-2-yl)aniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 174.07932 Da
Monoisotopic Mass: 1.7
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]+	175.08660	135.6
[M+Na]+	197.06854	149.3
[M+NH4]+	192.11314	144.5
[M+K]+	213.04248	144.9
[M-H]-	173.07204	141.1
[M+Na-2H]-	195.05399	143.9
[M]+	174.07877	139.1
[M]-	174.07987	139.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe