CID 80364774

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

Structural Information

Molecular Formula
C6H9ClN2O
SMILES
CC(C)C1=NOC(=C1Cl)N
InChI
InChI=1S/C6H9ClN2O/c1-3(2)5-4(7)6(8)10-9-5/h3H,8H2,1-2H3
InChIKey
CUGYLPMOJJDFSI-UHFFFAOYSA-N
Compound name
4-chloro-3-propan-2-yl-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

160.04034 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.04762 130.2
[M+Na]+ 183.02956 142.0
[M+NH4]+ 178.07416 138.5
[M+K]+ 199.00350 138.9
[M-H]- 159.03306 132.6
[M+Na-2H]- 181.01501 134.9
[M]+ 160.03979 132.7
[M]- 160.04089 132.7
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.