CID 11971464

1,2,4-triazin-3(2h)-one, 5,6-bis(4-methoxyphenyl)-2-ethenyl-

Structural Information

Molecular Formula
C19H17N3O3
SMILES
COC1=CC=C(C=C1)C2=NC(=O)N(N=C2C3=CC=C(C=C3)OC)C=C
InChI
InChI=1S/C19H17N3O3/c1-4-22-19(23)20-17(13-5-9-15(24-2)10-6-13)18(21-22)14-7-11-16(25-3)12-8-14/h4-12H,1H2,2-3H3
InChIKey
RXHRBFVSUNBBRK-UHFFFAOYSA-N
Compound name
2-ethenyl-5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.12698 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.13426 180.2
[M+Na]+ 358.11620 190.7
[M-H]- 334.11970 186.7
[M+NH4]+ 353.16080 189.7
[M+K]+ 374.09014 184.7
[M+H-H2O]+ 318.12424 168.5
[M+HCOO]- 380.12518 200.7
[M+CH3COO]- 394.14083 211.7
[M+Na-2H]- 356.10165 184.3
[M]+ 335.12643 184.3
[M]- 335.12753 184.3
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.