CID 63906021

1-(4-cyclopropyl-1,3-thiazol-2-yl)ethan-1-ol

Structural Information

Molecular Formula
C8H11NOS
SMILES
CC(C1=NC(=CS1)C2CC2)O
InChI
InChI=1S/C8H11NOS/c1-5(10)8-9-7(4-11-8)6-2-3-6/h4-6,10H,2-3H2,1H3
InChIKey
VXRSKOZTZBUVAA-UHFFFAOYSA-N
Compound name
1-(4-cyclopropyl-1,3-thiazol-2-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.05614 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.063416 130.8
[M+Na]+ 192.045358 140.9
[M-H]- 168.048864 136.3
[M+NH4]+ 187.089963 147.0
[M+K]+ 208.019298 137.5
[M+H-H2O]+ 152.053400 124.7
[M+HCOO]- 214.054341 148.3
[M+CH3COO]- 228.069991 178.3
[M+Na-2H]- 190.030806 132.3
[M]+ 169.05559142 134.3
[M]- 169.05668858 134.3
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.