CID 2731508

N-(4-fluoro-2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C10H11FN2S
SMILES
CC1=C(C=CC(=C1)F)NC2=NCCS2
InChI
InChI=1S/C10H11FN2S/c1-7-6-8(11)2-3-9(7)13-10-12-4-5-14-10/h2-3,6H,4-5H2,1H3,(H,12,13)
InChIKey
FUWXIXFHPRDTSQ-UHFFFAOYSA-N
Compound name
N-(4-fluoro-2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.0627 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.06998 141.5
[M+Na]+ 233.05192 150.6
[M-H]- 209.05542 146.3
[M+NH4]+ 228.09652 161.5
[M+K]+ 249.02586 146.6
[M+H-H2O]+ 193.05996 133.9
[M+HCOO]- 255.06090 160.3
[M+CH3COO]- 269.07655 154.7
[M+Na-2H]- 231.03737 143.5
[M]+ 210.06215 140.5
[M]- 210.06325 140.5
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.