CID 6477545

Nsc686424

Structural Information

Molecular Formula
C23H18N2O3
SMILES
C1=CC=C(C=C1)/C=C(\C2NC3=CC=CC=C3C(=O)O2)/NC(=O)C4=CC=CC=C4
InChI
InChI=1S/C23H18N2O3/c26-21(17-11-5-2-6-12-17)24-20(15-16-9-3-1-4-10-16)22-25-19-14-8-7-13-18(19)23(27)28-22/h1-15,22,25H,(H,24,26)/b20-15+
InChIKey
FARCUHZSYPQOOV-HMMYKYKNSA-N
Compound name
N-[(E)-1-(4-oxo-1,2-dihydro-3,1-benzoxazin-2-yl)-2-phenylethenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.13174 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.13902 187.6
[M+Na]+ 393.12096 191.5
[M-H]- 369.12446 194.9
[M+NH4]+ 388.16556 195.5
[M+K]+ 409.09490 185.9
[M+H-H2O]+ 353.12900 176.8
[M+HCOO]- 415.12994 203.3
[M+CH3COO]- 429.14559 195.5
[M+Na-2H]- 391.10641 191.5
[M]+ 370.13119 182.9
[M]- 370.13229 182.9
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.