CID 200795

Ag 247

Structural Information

Molecular Formula
C15H19N3O
SMILES
CC1=CC(=NN(C1=O)CCN(C)C)C2=CC=CC=C2
InChI
InChI=1S/C15H19N3O/c1-12-11-14(13-7-5-4-6-8-13)16-18(15(12)19)10-9-17(2)3/h4-8,11H,9-10H2,1-3H3
InChIKey
PAJRSFLRUWCAHK-UHFFFAOYSA-N
Compound name
2-[2-(dimethylamino)ethyl]-4-methyl-6-phenylpyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.1528 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.16008 160.0
[M+Na]+ 280.14202 168.5
[M-H]- 256.14552 165.7
[M+NH4]+ 275.18662 174.8
[M+K]+ 296.11596 165.1
[M+H-H2O]+ 240.15006 150.4
[M+HCOO]- 302.15100 183.2
[M+CH3COO]- 316.16665 203.4
[M+Na-2H]- 278.12747 165.1
[M]+ 257.15225 162.8
[M]- 257.15335 162.8
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.