CID 156446

74011-70-4

Structural Information

Molecular Formula

C₁₁H₁₆N₂O₂

SMILES

CC(C)(C)C1=CC(=NO1)NC(=O)C2CC2

InChI

InChI=1S/C11H16N2O2/c1-11(2,3)8-6-9(13-15-8)12-10(14)7-4-5-7/h6-7H,4-5H2,1-3H3,(H,12,13,14)

InChIKey

SSCBEUWAMORONB-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 208.12119 Da
Monoisotopic Mass: 2.0
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]+	209.12847	147.1
[M+Na]+	231.11041	156.1
[M-H]-	207.11391	154.3
[M+NH4]+	226.15501	160.4
[M+K]+	247.08435	154.4
[M+H-H2O]+	191.11845	140.6
[M+HCOO]-	253.11939	168.8
[M+CH3COO]-	267.13504	190.5
[M+Na-2H]-	229.09586	152.5
[M]+	208.12064	151.2
[M]-	208.12174	151.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe