CID 15956098

2-thiazolamine, n-[4-chloro-3-(2-furanylmethoxy)phenyl]-

Structural Information

Molecular Formula
C14H11ClN2O2S
SMILES
C1=COC(=C1)COC2=C(C=CC(=C2)NC3=NC=CS3)Cl
InChI
InChI=1S/C14H11ClN2O2S/c15-12-4-3-10(17-14-16-5-7-20-14)8-13(12)19-9-11-2-1-6-18-11/h1-8H,9H2,(H,16,17)
InChIKey
GJXXAJXDSXQMMA-UHFFFAOYSA-N
Compound name
N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

306.02298 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.03026 166.5
[M+Na]+ 329.01220 177.9
[M-H]- 305.01570 177.3
[M+NH4]+ 324.05680 183.8
[M+K]+ 344.98614 173.4
[M+H-H2O]+ 289.02024 159.9
[M+HCOO]- 351.02118 185.2
[M+CH3COO]- 365.03683 180.1
[M+Na-2H]- 326.99765 168.7
[M]+ 306.02243 174.7
[M]- 306.02353 174.7
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.