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]+ 390.217606 196.1
[M+Na]+ 412.199548 200.0
[M-H]- 388.203054 203.7
[M+NH4]+ 407.244153 204.0
[M+K]+ 428.173488 195.7
[M+H-H2O]+ 372.207590 184.1
[M+HCOO]- 434.208531 214.8
[M+CH3COO]- 448.224181 228.0
[M+Na-2H]- 410.184996 196.5
[M]+ 389.20978142 197.6
[M]- 389.21087858 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.