CID 66777253

1391052-76-8

Structural Information

Molecular Formula
C13H8Cl2F2N2O3
SMILES
C1=CC(=C(C=C1C(=O)NC2=C(C=NC=C2Cl)Cl)O)OC(F)F
InChI
InChI=1S/C13H8Cl2F2N2O3/c14-7-4-18-5-8(15)11(7)19-12(21)6-1-2-10(9(20)3-6)22-13(16)17/h1-5,13,20H,(H,18,19,21)
InChIKey
GZHTYXYJBZYTEV-UHFFFAOYSA-N
Compound name
N-(3,5-dichloropyridin-4-yl)-4-(difluoromethoxy)-3-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

347.988 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.99528 166.3
[M+Na]+ 370.97722 178.4
[M+NH4]+ 366.02182 171.6
[M+K]+ 386.95116 172.9
[M-H]- 346.98072 165.9
[M+Na-2H]- 368.96267 172.1
[M]+ 347.98745 168.1
[M]- 347.98855 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

literature stripe

Patent stripe

patents stripe