CID 16792013

760936-33-2

Structural Information

Molecular Formula
C10H8F2N2OS
SMILES
C1=CC=C(C(=C1)C2=CSC(=N2)N)OC(F)F
InChI
InChI=1S/C10H8F2N2OS/c11-9(12)15-8-4-2-1-3-6(8)7-5-16-10(13)14-7/h1-5,9H,(H2,13,14)
InChIKey
AOQXJXJNVGKOTO-UHFFFAOYSA-N
Compound name
4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.03255 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.03983 146.2
[M+Na]+ 265.02177 155.7
[M-H]- 241.02527 149.5
[M+NH4]+ 260.06637 164.4
[M+K]+ 280.99571 151.6
[M+H-H2O]+ 225.02981 137.5
[M+HCOO]- 287.03075 163.9
[M+CH3COO]- 301.04640 191.0
[M+Na-2H]- 263.00722 146.7
[M]+ 242.03200 145.5
[M]- 242.03310 145.5
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.