CID 15475835

332345-29-6

Structural Information

Molecular Formula
C8H10N2O3S
SMILES
C1COCCN1C2=NC=C(S2)C(=O)O
InChI
InChI=1S/C8H10N2O3S/c11-7(12)6-5-9-8(14-6)10-1-3-13-4-2-10/h5H,1-4H2,(H,11,12)
InChIKey
NILKOMDINYFEEX-UHFFFAOYSA-N
Compound name
2-morpholin-4-yl-1,3-thiazole-5-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

214.04121 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.04849 144.3
[M+Na]+ 237.03043 154.2
[M+NH4]+ 232.07503 151.5
[M+K]+ 253.00437 150.3
[M-H]- 213.03393 146.5
[M+Na-2H]- 235.01588 148.0
[M]+ 214.04066 146.5
[M]- 214.04176 146.5
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

patents stripe