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]+ 160.04268 131.4
[M+Na]+ 182.02462 139.6
[M-H]- 158.02812 132.8
[M+NH4]+ 177.06922 152.6
[M+K]+ 197.99856 138.4
[M+H-H2O]+ 142.03266 125.7
[M+HCOO]- 204.03360 149.1
[M+CH3COO]- 218.04925 171.1
[M+Na-2H]- 180.01007 133.6
[M]+ 159.03485 134.1
[M]- 159.03595 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.