CID 44144582

55902-07-3

Structural Information

Molecular Formula
C24H27N3O2
SMILES
CC(C)N(C(C)CC1=CC=CC=C1)C(=O)CN2C(=O)C=CC(=N2)C3=CC=CC=C3
InChI
InChI=1S/C24H27N3O2/c1-18(2)27(19(3)16-20-10-6-4-7-11-20)24(29)17-26-23(28)15-14-22(25-26)21-12-8-5-9-13-21/h4-15,18-19H,16-17H2,1-3H3
InChIKey
APHOOEGIIZQEQT-UHFFFAOYSA-N
Compound name
2-(6-oxo-3-phenylpyridazin-1-yl)-N-(1-phenylpropan-2-yl)-N-propan-2-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

389.21033 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 390.21761 196.1
[M+Na]+ 412.19955 200.0
[M-H]- 388.20305 203.7
[M+NH4]+ 407.24415 204.0
[M+K]+ 428.17349 195.7
[M+H-H2O]+ 372.20759 184.1
[M+HCOO]- 434.20853 214.8
[M+CH3COO]- 448.22418 228.0
[M+Na-2H]- 410.18500 196.5
[M]+ 389.20978 197.6
[M]- 389.21088 197.6
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.