CID 3087512

N-methyl-n-(3,4,4a,5-tetrahydro-3-oxo-2h-indeno(1,2-c)pyridazin-7-yl)propanamide

Structural Information

Molecular Formula
C15H17N3O2
SMILES
CCC(=O)N(C)C1=CC2=C(C=C1)C3=NNC(=O)CC3C2
InChI
InChI=1S/C15H17N3O2/c1-3-14(20)18(2)11-4-5-12-9(7-11)6-10-8-13(19)16-17-15(10)12/h4-5,7,10H,3,6,8H2,1-2H3,(H,16,19)
InChIKey
UFGXKYKYURMXFA-UHFFFAOYSA-N
Compound name
N-methyl-N-(3-oxo-2,4,4a,5-tetrahydroindeno[1,2-c]pyridazin-7-yl)propanamide
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]+ 272.13936 162.3
[M+Na]+ 294.12130 172.9
[M+NH4]+ 289.16590 169.6
[M+K]+ 310.09524 169.2
[M-H]- 270.12480 163.3
[M+Na-2H]- 292.10675 165.0
[M]+ 271.13153 163.8
[M]- 271.13263 163.8
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.