CID 216895

Acetamide, 2,2-dichloro-n-(3-phenyl-5-isoxazolyl)-

Structural Information

Molecular Formula
C11H8Cl2N2O2
SMILES
C1=CC=C(C=C1)C2=NOC(=C2)NC(=O)C(Cl)Cl
InChI
InChI=1S/C11H8Cl2N2O2/c12-10(13)11(16)14-9-6-8(15-17-9)7-4-2-1-3-5-7/h1-6,10H,(H,14,16)
InChIKey
MQCUVOXFQFEOTE-UHFFFAOYSA-N
Compound name
2,2-dichloro-N-(3-phenyl-1,2-oxazol-5-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.99628 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.003556 156.8
[M+Na]+ 292.985498 165.4
[M-H]- 268.989004 162.3
[M+NH4]+ 288.030103 172.9
[M+K]+ 308.959438 161.4
[M+H-H2O]+ 252.993540 150.2
[M+HCOO]- 314.994481 170.4
[M+CH3COO]- 329.010131 194.1
[M+Na-2H]- 290.970946 160.5
[M]+ 269.99573142 160.4
[M]- 269.99682858 160.4
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.