CID 3039048

Brn 0841867

Structural Information

Molecular Formula
C19H15N3O4
SMILES
C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)C(NC(=O)C3=NC=CN=C3)O
InChI
InChI=1S/C19H15N3O4/c23-17(19(25)22-18(24)16-12-20-10-11-21-16)13-6-8-15(9-7-13)26-14-4-2-1-3-5-14/h1-12,19,25H,(H,22,24)
InChIKey
MLVXCDJNGXJHBC-UHFFFAOYSA-N
Compound name
N-[1-hydroxy-2-oxo-2-(4-phenoxyphenyl)ethyl]pyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

349.10626 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.11354 179.9
[M+Na]+ 372.09548 192.9
[M+NH4]+ 367.14008 185.1
[M+K]+ 388.06942 187.5
[M-H]- 348.09898 183.7
[M+Na-2H]- 370.08093 189.4
[M]+ 349.10571 182.6
[M]- 349.10681 182.6
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.