CID 2886306

473445-09-9

Structural Information

Molecular Formula
C17H15F2N3O3
SMILES
C1=CC=C2C(=C1)NC(C(=O)N2)CC(=O)NC3=CC=C(C=C3)OC(F)F
InChI
InChI=1S/C17H15F2N3O3/c18-17(19)25-11-7-5-10(6-8-11)20-15(23)9-14-16(24)22-13-4-2-1-3-12(13)21-14/h1-8,14,17,21H,9H2,(H,20,23)(H,22,24)
InChIKey
NZIYHVHOYHXPLY-UHFFFAOYSA-N
Compound name
N-[4-(difluoromethoxy)phenyl]-2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

347.10815 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.11543 177.0
[M+Na]+ 370.09737 182.4
[M-H]- 346.10087 176.0
[M+NH4]+ 365.14197 186.1
[M+K]+ 386.07131 176.2
[M+H-H2O]+ 330.10541 165.8
[M+HCOO]- 392.10635 189.4
[M+CH3COO]- 406.12200 209.8
[M+Na-2H]- 368.08282 179.0
[M]+ 347.10760 170.4
[M]- 347.10870 170.4
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

No patent data available for this compound.