CID 63525974

1344304-10-4

Structural Information

Molecular Formula
C12H10FNOS
SMILES
CC1=C(N=C(S1)C(=O)C)C2=CC=C(C=C2)F
InChI
InChI=1S/C12H10FNOS/c1-7(15)12-14-11(8(2)16-12)9-3-5-10(13)6-4-9/h3-6H,1-2H3
InChIKey
AUPSDVRLQSSWIH-UHFFFAOYSA-N
Compound name
1-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.0467 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.05398 151.8
[M+Na]+ 258.03592 164.6
[M+NH4]+ 253.08052 160.2
[M+K]+ 274.00986 157.6
[M-H]- 234.03942 154.0
[M+Na-2H]- 256.02137 158.2
[M]+ 235.04615 154.7
[M]- 235.04725 154.7
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.