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]+ 201.98364 136.9
[M+Na]+ 223.96558 150.3
[M-H]- 199.96908 143.3
[M+NH4]+ 219.01018 157.2
[M+K]+ 239.93952 147.2
[M+H-H2O]+ 183.97362 131.2
[M+HCOO]- 245.97456 154.3
[M+CH3COO]- 259.99021 152.0
[M+Na-2H]- 221.95103 139.5
[M]+ 200.97581 142.4
[M]- 200.97691 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.