CID 704317

16781-67-2

Structural Information

Molecular Formula
C7H10N2O2S
SMILES
C1COCCN1C2=NC(=O)CS2
InChI
InChI=1S/C7H10N2O2S/c10-6-5-12-7(8-6)9-1-3-11-4-2-9/h1-5H2
InChIKey
HKPOETYJKCUXBF-UHFFFAOYSA-N
Compound name
2-morpholin-4-yl-1,3-thiazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

19
Patents

186.0463 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.053576 137.4
[M+Na]+ 209.035518 144.9
[M-H]- 185.039024 141.9
[M+NH4]+ 204.080123 155.4
[M+K]+ 225.009458 144.3
[M+H-H2O]+ 169.043560 130.6
[M+HCOO]- 231.044501 151.5
[M+CH3COO]- 245.060151 150.0
[M+Na-2H]- 207.020966 139.2
[M]+ 186.04575142 135.6
[M]- 186.04684858 135.6
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.