CID 17229122

4-(3-chlorophenyl)-3-methyl-2,5-dihydro-1,2-oxazol-5-imine

Structural Information

Molecular Formula
C10H9ClN2O
SMILES
CC1=NOC(=C1C2=CC(=CC=C2)Cl)N
InChI
InChI=1S/C10H9ClN2O/c1-6-9(10(12)14-13-6)7-3-2-4-8(11)5-7/h2-5H,12H2,1H3
InChIKey
FPZYVCHIGUSBEM-UHFFFAOYSA-N
Compound name
4-(3-chlorophenyl)-3-methyl-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.04034 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.04762 141.9
[M+Na]+ 231.02956 156.8
[M+NH4]+ 226.07416 151.0
[M+K]+ 247.00350 151.7
[M-H]- 207.03306 147.4
[M+Na-2H]- 229.01501 150.0
[M]+ 208.03979 146.0
[M]- 208.04089 146.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

Patent stripe

No patent data available for this compound.