CID 1090093

(5,6-dihydro-4h-[1,3]thiazin-2-yl)-(3-trifluoromethyl-phenyl)-amine

Structural Information

Molecular Formula
C11H11F3N2S
SMILES
C1CN=C(SC1)NC2=CC=CC(=C2)C(F)(F)F
InChI
InChI=1S/C11H11F3N2S/c12-11(13,14)8-3-1-4-9(7-8)16-10-15-5-2-6-17-10/h1,3-4,7H,2,5-6H2,(H,15,16)
InChIKey
HTFGSFVRDNBLNS-UHFFFAOYSA-N
Compound name
N-[3-(trifluoromethyl)phenyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

260.0595 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.06678 151.4
[M+Na]+ 283.04872 158.5
[M-H]- 259.05222 152.4
[M+NH4]+ 278.09332 166.9
[M+K]+ 299.02266 153.4
[M+H-H2O]+ 243.05676 141.3
[M+HCOO]- 305.05770 163.8
[M+CH3COO]- 319.07335 193.2
[M+Na-2H]- 281.03417 154.8
[M]+ 260.05895 145.1
[M]- 260.06005 145.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.