CID 46785207

2-methoxy-1-(1,3-thiazol-2-yl)ethan-1-ol

Structural Information

Molecular Formula
C6H9NO2S
SMILES
COCC(C1=NC=CS1)O
InChI
InChI=1S/C6H9NO2S/c1-9-4-5(8)6-7-2-3-10-6/h2-3,5,8H,4H2,1H3
InChIKey
CPBLBIZMGLWKAW-UHFFFAOYSA-N
Compound name
2-methoxy-1-(1,3-thiazol-2-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.0354 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.042676 131.4
[M+Na]+ 182.024618 139.6
[M-H]- 158.028124 132.8
[M+NH4]+ 177.069223 152.6
[M+K]+ 197.998558 138.4
[M+H-H2O]+ 142.032660 125.7
[M+HCOO]- 204.033601 149.1
[M+CH3COO]- 218.049251 171.1
[M+Na-2H]- 180.010066 133.6
[M]+ 159.03485142 134.1
[M]- 159.03594858 134.1
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.