CID 6477548

Nsc686428

Structural Information

Molecular Formula
C23H16N2O3
SMILES
C1=CC=C(C=C1)/C=C(\C2=NC3=CC=CC=C3C(=O)O2)/NC(=O)C4=CC=CC=C4
InChI
InChI=1S/C23H16N2O3/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/h1-15H,(H,24,26)/b20-15+
InChIKey
JIXGQNSCELFPAM-HMMYKYKNSA-N
Compound name
N-[(E)-1-(4-oxo-3,1-benzoxazin-2-yl)-2-phenylethenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

368.1161 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.12338 187.5
[M+Na]+ 391.10532 193.7
[M-H]- 367.10882 196.9
[M+NH4]+ 386.14992 196.3
[M+K]+ 407.07926 188.6
[M+H-H2O]+ 351.11336 176.1
[M+HCOO]- 413.11430 207.3
[M+CH3COO]- 427.12995 197.0
[M+Na-2H]- 389.09077 193.5
[M]+ 368.11555 187.2
[M]- 368.11665 187.2
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.