CID 43144267

2-(1-chloroethyl)-5-(4-chlorophenyl)-1,3-oxazole

Structural Information

Molecular Formula
C11H9Cl2NO
SMILES
CC(C1=NC=C(O1)C2=CC=C(C=C2)Cl)Cl
InChI
InChI=1S/C11H9Cl2NO/c1-7(12)11-14-6-10(15-11)8-2-4-9(13)5-3-8/h2-7H,1H3
InChIKey
XKCNPRPSWNAOPX-UHFFFAOYSA-N
Compound name
2-(1-chloroethyl)-5-(4-chlorophenyl)-1,3-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.00612 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.01340 148.6
[M+Na]+ 263.99534 164.5
[M+NH4]+ 259.03994 158.0
[M+K]+ 279.96928 158.3
[M-H]- 239.99884 153.4
[M+Na-2H]- 261.98079 156.9
[M]+ 241.00557 153.0
[M]- 241.00667 153.0
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.