CID 3079070

4,5-dihydro-5-methyl-6-(4-(methylamino)-7-quinazolinyl)-3(2h)-pyridazinone

Structural Information

Molecular Formula
C14H15N5O
SMILES
CC1CC(=O)NN=C1C2=CC3=C(C=C2)C(=NC=N3)NC
InChI
InChI=1S/C14H15N5O/c1-8-5-12(20)18-19-13(8)9-3-4-10-11(6-9)16-7-17-14(10)15-2/h3-4,6-8H,5H2,1-2H3,(H,18,20)(H,15,16,17)
InChIKey
MQSGWYLKTMXZLY-UHFFFAOYSA-N
Compound name
4-methyl-3-[4-(methylamino)quinazolin-7-yl]-4,5-dihydro-1H-pyridazin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

269.12766 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.13494 165.4
[M+Na]+ 292.11688 174.1
[M-H]- 268.12038 166.4
[M+NH4]+ 287.16148 176.4
[M+K]+ 308.09082 167.7
[M+H-H2O]+ 252.12492 154.9
[M+HCOO]- 314.12586 181.0
[M+CH3COO]- 328.14151 175.0
[M+Na-2H]- 290.10233 171.7
[M]+ 269.12711 162.1
[M]- 269.12821 162.1
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