CID 338392

73239-82-4

Structural Information

Molecular Formula
C23H20N2O3
SMILES
COC1=CC=C(C=C1)C2CN(N=C(O2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4
InChI
InChI=1S/C23H20N2O3/c1-27-20-14-12-17(13-15-20)21-16-25(23(26)19-10-6-3-7-11-19)24-22(28-21)18-8-4-2-5-9-18/h2-15,21H,16H2,1H3
InChIKey
RHXNRQRNNFGWSU-UHFFFAOYSA-N
Compound name
[6-(4-methoxyphenyl)-2-phenyl-5,6-dihydro-1,3,4-oxadiazin-4-yl]-phenylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.1474 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.15468 191.0
[M+Na]+ 395.13662 196.7
[M-H]- 371.14012 200.8
[M+NH4]+ 390.18122 197.5
[M+K]+ 411.11056 192.2
[M+H-H2O]+ 355.14466 178.1
[M+HCOO]- 417.14560 207.7
[M+CH3COO]- 431.16125 199.8
[M+Na-2H]- 393.12207 194.0
[M]+ 372.14685 190.0
[M]- 372.14795 190.0
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.