CID 3015803

5-methylbenzoxazole-2-acetamide

Structural Information

Molecular Formula

C₁₀H₁₀N₂O₂

SMILES

CC1=CC2=C(C=C1)OC(=N2)CC(=O)N

InChI

InChI=1S/C10H10N2O2/c1-6-2-3-8-7(4-6)12-10(14-8)5-9(11)13/h2-4H,5H2,1H3,(H2,11,13)

InChIKey

SVDXZZAXEZBBNY-UHFFFAOYSA-N

Compound name

2-(5-methyl-1,3-benzoxazol-2-yl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 190.07423 Da
Monoisotopic Mass: 1.0
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]+	191.081506	138.3
[M+Na]+	213.063448	148.7
[M-H]-	189.066954	142.7
[M+NH4]+	208.108053	158.0
[M+K]+	229.037388	147.0
[M+H-H2O]+	173.071490	132.0
[M+HCOO]-	235.072431	162.4
[M+CH3COO]-	249.088081	184.7
[M+Na-2H]-	211.048896	145.1
[M]+	190.07368142	141.3
[M]-	190.07477858	141.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe