CID 71316959

N-formyl oxcarbazepine

Structural Information

Molecular Formula
C16H12N2O3
SMILES
C1C2=CC=CC=C2N(C3=CC=CC=C3C1=O)C(=O)NC=O
InChI
InChI=1S/C16H12N2O3/c19-10-17-16(21)18-13-7-3-1-5-11(13)9-15(20)12-6-2-4-8-14(12)18/h1-8,10H,9H2,(H,17,19,21)
InChIKey
FOEYBWXNDHBTBV-UHFFFAOYSA-N
Compound name
N-formyl-5-oxo-6H-benzo[b][1]benzazepine-11-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

280.08478 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.09206 160.6
[M+Na]+ 303.07400 171.8
[M+NH4]+ 298.11860 167.3
[M+K]+ 319.04794 166.6
[M-H]- 279.07750 162.6
[M+Na-2H]- 301.05945 165.8
[M]+ 280.08423 162.6
[M]- 280.08533 162.6
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

patents stripe