CID 61805818

1-[2-(2-methoxyethyl)-4-methyl-1,3-thiazol-5-yl]ethan-1-ol

Structural Information

Molecular Formula
C9H15NO2S
SMILES
CC1=C(SC(=N1)CCOC)C(C)O
InChI
InChI=1S/C9H15NO2S/c1-6-9(7(2)11)13-8(10-6)4-5-12-3/h7,11H,4-5H2,1-3H3
InChIKey
GYXVNLMCQTXZJT-UHFFFAOYSA-N
Compound name
1-[2-(2-methoxyethyl)-4-methyl-1,3-thiazol-5-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.08235 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.08963 143.7
[M+Na]+ 224.07157 152.4
[M-H]- 200.07507 145.3
[M+NH4]+ 219.11617 163.9
[M+K]+ 240.04551 150.3
[M+H-H2O]+ 184.07961 138.1
[M+HCOO]- 246.08055 160.4
[M+CH3COO]- 260.09620 182.4
[M+Na-2H]- 222.05702 143.2
[M]+ 201.08180 148.3
[M]- 201.08290 148.3
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.