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]+ 336.134256 180.2
[M+Na]+ 358.116198 190.7
[M-H]- 334.119704 186.7
[M+NH4]+ 353.160803 189.7
[M+K]+ 374.090138 184.7
[M+H-H2O]+ 318.124240 168.5
[M+HCOO]- 380.125181 200.7
[M+CH3COO]- 394.140831 211.7
[M+Na-2H]- 356.101646 184.3
[M]+ 335.12643142 184.3
[M]- 335.12752858 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.