CID 165855268

3-(2-chloro-1,3-thiazol-5-yl)-1,2-oxazol-5-amine

Structural Information

Molecular Formula
C6H4ClN3OS
SMILES
C1=C(ON=C1C2=CN=C(S2)Cl)N
InChI
InChI=1S/C6H4ClN3OS/c7-6-9-2-4(12-6)3-1-5(8)11-10-3/h1-2H,8H2
InChIKey
ZQIWYUWVCRFNCH-UHFFFAOYSA-N
Compound name
3-(2-chloro-1,3-thiazol-5-yl)-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.97636 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.983636 136.9
[M+Na]+ 223.965578 150.3
[M-H]- 199.969084 143.3
[M+NH4]+ 219.010183 157.2
[M+K]+ 239.939518 147.2
[M+H-H2O]+ 183.973620 131.2
[M+HCOO]- 245.974561 154.3
[M+CH3COO]- 259.990211 152.0
[M+Na-2H]- 221.951026 139.5
[M]+ 200.97581142 142.4
[M]- 200.97690858 142.4
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.