CID 44144593

1(6h)-pyridazineacteamide, 3-methyl-n-alpha-methylbenzyl-6-oxo-

Structural Information

Molecular Formula
C15H17N3O2
SMILES
CC1=NN(C(=O)C=C1)CC(=O)N(C)CC2=CC=CC=C2
InChI
InChI=1S/C15H17N3O2/c1-12-8-9-14(19)18(16-12)11-15(20)17(2)10-13-6-4-3-5-7-13/h3-9H,10-11H2,1-2H3
InChIKey
GNQAVJCRIQYAFB-UHFFFAOYSA-N
Compound name
N-benzyl-N-methyl-2-(3-methyl-6-oxopyridazin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.13208 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.139356 162.0
[M+Na]+ 294.121298 169.6
[M-H]- 270.124804 167.6
[M+NH4]+ 289.165903 175.8
[M+K]+ 310.095238 166.7
[M+H-H2O]+ 254.129340 152.3
[M+HCOO]- 316.130281 184.7
[M+CH3COO]- 330.145931 203.7
[M+Na-2H]- 292.106746 166.8
[M]+ 271.13153142 164.5
[M]- 271.13262858 164.5
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.