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]+ 292.121106 166.1
[M+Na]+ 314.103048 176.3
[M-H]- 290.106554 171.9
[M+NH4]+ 309.147653 180.7
[M+K]+ 330.076988 171.2
[M+H-H2O]+ 274.111090 157.2
[M+HCOO]- 336.112031 184.7
[M+CH3COO]- 350.127681 208.2
[M+Na-2H]- 312.088496 170.0
[M]+ 291.11328142 171.5
[M]- 291.11437858 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.