CID 3039170

Brn 1012050

Structural Information

Molecular Formula
C15H17N3O3
SMILES
CC(C)(C)C1=CC=C(C=C1)C2=NC(=C(O2)C(=O)N)C(=O)N
InChI
InChI=1S/C15H17N3O3/c1-15(2,3)9-6-4-8(5-7-9)14-18-10(12(16)19)11(21-14)13(17)20/h4-7H,1-3H3,(H2,16,19)(H2,17,20)
InChIKey
OPYVKTXZCBYMAY-UHFFFAOYSA-N
Compound name
2-(4-tert-butylphenyl)-1,3-oxazole-4,5-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.12698 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.13426 167.0
[M+Na]+ 310.11620 176.4
[M+NH4]+ 305.16080 172.1
[M+K]+ 326.09014 175.6
[M-H]- 286.11970 169.9
[M+Na-2H]- 308.10165 171.0
[M]+ 287.12643 168.8
[M]- 287.12753 168.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.