CID 43144205

2-(chloromethyl)-5-(4-chlorophenyl)-4-methyl-1,3-oxazole

Structural Information

Molecular Formula
C11H9Cl2NO
SMILES
CC1=C(OC(=N1)CCl)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C11H9Cl2NO/c1-7-11(15-10(6-12)14-7)8-2-4-9(13)5-3-8/h2-5H,6H2,1H3
InChIKey
RDYSXEWAVCFZBK-UHFFFAOYSA-N
Compound name
2-(chloromethyl)-5-(4-chlorophenyl)-4-methyl-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 148.3
[M+Na]+ 263.99534 164.9
[M+NH4]+ 259.03994 157.8
[M+K]+ 279.96928 158.1
[M-H]- 239.99884 153.4
[M+Na-2H]- 261.98079 156.7
[M]+ 241.00557 152.9
[M]- 241.00667 152.9
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.