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]+ 294.09068 163.7
[M+Na]+ 316.07262 170.9
[M-H]- 292.07612 172.8
[M+NH4]+ 311.11722 177.3
[M+K]+ 332.04656 170.2
[M+H-H2O]+ 276.08066 156.4
[M+HCOO]- 338.08160 180.6
[M+CH3COO]- 352.09725 175.5
[M+Na-2H]- 314.05807 164.4
[M]+ 293.08285 166.0
[M]- 293.08395 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.