CID 2388912

2-chloro-n-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]acetamide

Structural Information

Molecular Formula
C11H7ClF2N2OS
SMILES
C1=CC(=C(C=C1C2=CSC(=N2)NC(=O)CCl)F)F
InChI
InChI=1S/C11H7ClF2N2OS/c12-4-10(17)16-11-15-9(5-18-11)6-1-2-7(13)8(14)3-6/h1-3,5H,4H2,(H,15,16,17)
InChIKey
RHYUQCLMSGAKMN-UHFFFAOYSA-N
Compound name
2-chloro-N-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.99356 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.00084 156.0
[M+Na]+ 310.98278 166.9
[M-H]- 286.98628 159.9
[M+NH4]+ 306.02738 173.7
[M+K]+ 326.95672 160.7
[M+H-H2O]+ 270.99082 148.1
[M+HCOO]- 332.99176 169.5
[M+CH3COO]- 347.00741 198.0
[M+Na-2H]- 308.96823 155.8
[M]+ 287.99301 158.2
[M]- 287.99411 158.2
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.