CID 9588157

N'-(5-((2-chloro-6-fluorophenyl)methyl)-1,2,4-oxadiazol-3-yl)-n,n-dimethylmethanimidamide

Structural Information

Molecular Formula
C12H12ClFN4O
SMILES
CN(C)/C=N/C1=NOC(=N1)CC2=C(C=CC=C2Cl)F
InChI
InChI=1S/C12H12ClFN4O/c1-18(2)7-15-12-16-11(19-17-12)6-8-9(13)4-3-5-10(8)14/h3-5,7H,6H2,1-2H3/b15-7+
InChIKey
ONKJITMWJNQHCJ-VIZOYTHASA-N
Compound name
N'-[5-[(2-chloro-6-fluorophenyl)methyl]-1,2,4-oxadiazol-3-yl]-N,N-dimethylmethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.06836 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.07564 163.0
[M+Na]+ 305.05758 173.1
[M-H]- 281.06108 169.5
[M+NH4]+ 300.10218 178.5
[M+K]+ 321.03152 170.1
[M+H-H2O]+ 265.06562 153.1
[M+HCOO]- 327.06656 183.8
[M+CH3COO]- 341.08221 207.3
[M+Na-2H]- 303.04303 167.2
[M]+ 282.06781 168.1
[M]- 282.06891 168.1
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.