CID 9567571

3-[(e)-thiazol-2-ylmethyleneamino]oxazolidin-2-one

Structural Information

Molecular Formula
C7H7N3O2S
SMILES
C1COC(=O)N1/N=C/C2=NC=CS2
InChI
InChI=1S/C7H7N3O2S/c11-7-10(2-3-12-7)9-5-6-8-1-4-13-6/h1,4-5H,2-3H2/b9-5+
InChIKey
RAPJVHQNIJXZID-WEVVVXLNSA-N
Compound name
3-[(E)-1,3-thiazol-2-ylmethylideneamino]-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

197.0259 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.03318 139.3
[M+Na]+ 220.01512 148.6
[M-H]- 196.01862 146.1
[M+NH4]+ 215.05972 159.1
[M+K]+ 235.98906 148.3
[M+H-H2O]+ 180.02316 132.5
[M+HCOO]- 242.02410 159.7
[M+CH3COO]- 256.03975 181.4
[M+Na-2H]- 218.00057 141.4
[M]+ 197.02535 141.6
[M]- 197.02645 141.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.