CID 207163

Ag 260

Structural Information

Molecular Formula
C15H18ClN3O
SMILES
CC1=CC(=NN(C1=O)CCN(C)C)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C15H18ClN3O/c1-11-10-14(12-4-6-13(16)7-5-12)17-19(15(11)20)9-8-18(2)3/h4-7,10H,8-9H2,1-3H3
InChIKey
DIKKTZRBLBMRJO-UHFFFAOYSA-N
Compound name
6-(4-chlorophenyl)-2-[2-(dimethylamino)ethyl]-4-methylpyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.11383 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.12111 166.1
[M+Na]+ 314.10305 176.3
[M-H]- 290.10655 171.9
[M+NH4]+ 309.14765 180.7
[M+K]+ 330.07699 171.2
[M+H-H2O]+ 274.11109 157.2
[M+HCOO]- 336.11203 184.7
[M+CH3COO]- 350.12768 208.2
[M+Na-2H]- 312.08850 170.0
[M]+ 291.11328 171.5
[M]- 291.11438 171.5
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.