CID 3067450

2-(2-methoxyethoxy)ethyl oxo((4-phenyl-2-thiazolyl)amino)acetate

Structural Information

Molecular Formula
C16H18N2O5S
SMILES
COCCOCCOC(=O)C(=O)NC1=NC(=CS1)C2=CC=CC=C2
InChI
InChI=1S/C16H18N2O5S/c1-21-7-8-22-9-10-23-15(20)14(19)18-16-17-13(11-24-16)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,17,18,19)
InChIKey
WWCOCLGHUGETIT-UHFFFAOYSA-N
Compound name
2-(2-methoxyethoxy)ethyl 2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.09363 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.10091 180.6
[M+Na]+ 373.08285 189.3
[M+NH4]+ 368.12745 185.8
[M+K]+ 389.05679 184.3
[M-H]- 349.08635 181.8
[M+Na-2H]- 371.06830 185.1
[M]+ 350.09308 182.2
[M]- 350.09418 182.2
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.