CID 2121619

N-[4-(chloromethyl)-1,3-thiazol-2-yl]-n-(2-fluorophenyl)acetamide

Structural Information

Molecular Formula
C12H10ClFN2OS
SMILES
CC(=O)N(C1=CC=CC=C1F)C2=NC(=CS2)CCl
InChI
InChI=1S/C12H10ClFN2OS/c1-8(17)16(11-5-3-2-4-10(11)14)12-15-9(6-13)7-18-12/h2-5,7H,6H2,1H3
InChIKey
DKBWAVMTAZCTTP-UHFFFAOYSA-N
Compound name
N-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-(2-fluorophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.01865 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.02593 159.2
[M+Na]+ 307.00787 171.2
[M+NH4]+ 302.05247 167.4
[M+K]+ 322.98181 164.3
[M-H]- 283.01137 161.8
[M+Na-2H]- 304.99332 166.1
[M]+ 284.01810 162.3
[M]- 284.01920 162.3
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.

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No patent data available for this compound.