CID 44144579

55902-04-0

Structural Information

Molecular Formula
C19H23N3O2
SMILES
CC1=NN(C(=O)C=C1)CC(=O)N(CC=C)C(C)CC2=CC=CC=C2
InChI
InChI=1S/C19H23N3O2/c1-4-12-21(16(3)13-17-8-6-5-7-9-17)19(24)14-22-18(23)11-10-15(2)20-22/h4-11,16H,1,12-14H2,2-3H3
InChIKey
CJMKAKKCVQLXRE-UHFFFAOYSA-N
Compound name
2-(3-methyl-6-oxopyridazin-1-yl)-N-(1-phenylpropan-2-yl)-N-prop-2-enylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.17902 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.18630 178.0
[M+Na]+ 348.16824 190.5
[M+NH4]+ 343.21284 183.5
[M+K]+ 364.14218 183.9
[M-H]- 324.17174 180.7
[M+Na-2H]- 346.15369 185.1
[M]+ 325.17847 180.3
[M]- 325.17957 180.3
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.