CID 97627132

2-[(1,3-thiazol-2-yl)methoxy]acetic acid hydrochloride

Structural Information

Molecular Formula
C6H7NO3S
SMILES
C1=CSC(=N1)COCC(=O)O
InChI
InChI=1S/C6H7NO3S/c8-6(9)4-10-3-5-7-1-2-11-5/h1-2H,3-4H2,(H,8,9)
InChIKey
DDMVHCHWCIGKTJ-UHFFFAOYSA-N
Compound name
2-(1,3-thiazol-2-ylmethoxy)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.01466 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.021936 133.8
[M+Na]+ 196.003878 142.1
[M-H]- 172.007384 135.1
[M+NH4]+ 191.048483 154.2
[M+K]+ 211.977818 140.7
[M+H-H2O]+ 156.011920 128.0
[M+HCOO]- 218.012861 151.9
[M+CH3COO]- 232.028511 172.2
[M+Na-2H]- 193.989326 136.1
[M]+ 173.01411142 137.1
[M]- 173.01520858 137.1
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.