CID 54058

Bb 30

Structural Information

Molecular Formula
C24H27N3O3
SMILES
CN(C)CCN1C(=O)C(C(=O)N(C1=O)CC2=CC=CC=C2)(CC=C)C3=CC=CC=C3
InChI
InChI=1S/C24H27N3O3/c1-4-15-24(20-13-9-6-10-14-20)21(28)26(17-16-25(2)3)23(30)27(22(24)29)18-19-11-7-5-8-12-19/h4-14H,1,15-18H2,2-3H3
InChIKey
UQIDVINWTTYAII-UHFFFAOYSA-N
Compound name
1-benzyl-3-[2-(dimethylamino)ethyl]-5-phenyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

405.20523 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 406.21251 199.5
[M+Na]+ 428.19445 212.6
[M+NH4]+ 423.23905 206.1
[M+K]+ 444.16839 202.8
[M-H]- 404.19795 204.1
[M+Na-2H]- 426.17990 207.9
[M]+ 405.20468 202.7
[M]- 405.20578 202.7
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.