CID 14414

Hexamid

Structural Information

Molecular Formula
C18H25N3O3
SMILES
CCC1(C(=O)NC(=O)N(C1=O)CCN(CC)CC)C2=CC=CC=C2
InChI
InChI=1S/C18H25N3O3/c1-4-18(14-10-8-7-9-11-14)15(22)19-17(24)21(16(18)23)13-12-20(5-2)6-3/h7-11H,4-6,12-13H2,1-3H3,(H,19,22,24)
InChIKey
JPSKYEDINNEHEB-UHFFFAOYSA-N
Compound name
1-[2-(diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

331.1896 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.19688 180.3
[M+Na]+ 354.17882 190.8
[M+NH4]+ 349.22342 186.6
[M+K]+ 370.15276 183.0
[M-H]- 330.18232 181.9
[M+Na-2H]- 352.16427 185.8
[M]+ 331.18905 182.0
[M]- 331.19015 182.0
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

patents stripe