CID 216888

37852-50-9

Structural Information

Molecular Formula
C13H15N3O3S
SMILES
C1COCCN1CC(=O)NC2=CC(=NO2)C3=CC=CS3
InChI
InChI=1S/C13H15N3O3S/c17-12(9-16-3-5-18-6-4-16)14-13-8-10(15-19-13)11-2-1-7-20-11/h1-2,7-8H,3-6,9H2,(H,14,17)
InChIKey
WSJUSFIJLGCEHL-UHFFFAOYSA-N
Compound name
2-morpholin-4-yl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.0834 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.090676 163.7
[M+Na]+ 316.072618 170.9
[M-H]- 292.076124 172.8
[M+NH4]+ 311.117223 177.3
[M+K]+ 332.046558 170.2
[M+H-H2O]+ 276.080660 156.4
[M+HCOO]- 338.081601 180.6
[M+CH3COO]- 352.097251 175.5
[M+Na-2H]- 314.058066 164.4
[M]+ 293.08285142 166.0
[M]- 293.08394858 166.0
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.