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]+ 271.00356 156.8
[M+Na]+ 292.98550 165.4
[M-H]- 268.98900 162.3
[M+NH4]+ 288.03010 172.9
[M+K]+ 308.95944 161.4
[M+H-H2O]+ 252.99354 150.2
[M+HCOO]- 314.99448 170.4
[M+CH3COO]- 329.01013 194.1
[M+Na-2H]- 290.97095 160.5
[M]+ 269.99573 160.4
[M]- 269.99683 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.