CID 97033776

4-fluoro-2-(2-methylthiazol-4-yl)phenol

Structural Information

Molecular Formula
C10H8FNOS
SMILES
CC1=NC(=CS1)C2=C(C=CC(=C2)F)O
InChI
InChI=1S/C10H8FNOS/c1-6-12-9(5-14-6)8-4-7(11)2-3-10(8)13/h2-5,13H,1H3
InChIKey
ZPWOYAQNLTWCHB-UHFFFAOYSA-N
Compound name
4-fluoro-2-(2-methyl-1,3-thiazol-4-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.03107 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.03835 139.7
[M+Na]+ 232.02029 151.0
[M-H]- 208.02379 144.0
[M+NH4]+ 227.06489 159.7
[M+K]+ 247.99423 146.5
[M+H-H2O]+ 192.02833 133.0
[M+HCOO]- 254.02927 157.6
[M+CH3COO]- 268.04492 153.5
[M+Na-2H]- 230.00574 141.0
[M]+ 209.03052 140.9
[M]- 209.03162 140.9
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.