CID 3068161

83089-58-1

Structural Information

Molecular Formula
C11H10N2O4S
SMILES
CCOC(=O)C(=O)NC1=NC(=CS1)C2=CC=CO2
InChI
InChI=1S/C11H10N2O4S/c1-2-16-10(15)9(14)13-11-12-7(6-18-11)8-4-3-5-17-8/h3-6H,2H2,1H3,(H,12,13,14)
InChIKey
XMEWWFLNPIMVLI-UHFFFAOYSA-N
Compound name
ethyl 2-[[4-(furan-2-yl)-1,3-thiazol-2-yl]amino]-2-oxoacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

266.03613 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.04341 158.4
[M+Na]+ 289.02535 167.9
[M+NH4]+ 284.06995 164.7
[M+K]+ 304.99929 165.9
[M-H]- 265.02885 161.0
[M+Na-2H]- 287.01080 162.9
[M]+ 266.03558 160.6
[M]- 266.03668 160.6
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.