CID 3045255

4(1h)-pyridazinone, 3-methoxy-6-methyl-1-(3,4,5-trimethoxyphenyl)-

Structural Information

Molecular Formula
C15H18N2O5
SMILES
CC1=CC(=O)C(=NN1C2=CC(=C(C(=C2)OC)OC)OC)OC
InChI
InChI=1S/C15H18N2O5/c1-9-6-11(18)15(22-5)16-17(9)10-7-12(19-2)14(21-4)13(8-10)20-3/h6-8H,1-5H3
InChIKey
MUXYIRUKURTNKQ-UHFFFAOYSA-N
Compound name
3-methoxy-6-methyl-1-(3,4,5-trimethoxyphenyl)pyridazin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

306.12158 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.128856 167.4
[M+Na]+ 329.110798 178.7
[M-H]- 305.114304 172.9
[M+NH4]+ 324.155403 180.5
[M+K]+ 345.084738 176.8
[M+H-H2O]+ 289.118840 158.2
[M+HCOO]- 351.119781 189.8
[M+CH3COO]- 365.135431 207.3
[M+Na-2H]- 327.096246 170.8
[M]+ 306.12103142 176.6
[M]- 306.12212858 176.6
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

patents stripe