CID 135463946

Brn 5600110

Structural Information

Molecular Formula
C18H26N4O2
SMILES
CCC1(C(=NC2=CC=C(C=C2)N(CC)CC)NC(=O)NC1=O)CC
InChI
InChI=1S/C18H26N4O2/c1-5-18(6-2)15(20-17(24)21-16(18)23)19-13-9-11-14(12-10-13)22(7-3)8-4/h9-12H,5-8H2,1-4H3,(H2,19,20,21,23,24)
InChIKey
OCVHJBOYUVFLIM-UHFFFAOYSA-N
Compound name
6-[4-(diethylamino)phenyl]imino-5,5-diethyl-1,3-diazinane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

330.20557 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.21285 181.0
[M+Na]+ 353.19479 190.7
[M+NH4]+ 348.23939 187.3
[M+K]+ 369.16873 182.8
[M-H]- 329.19829 183.3
[M+Na-2H]- 351.18024 186.6
[M]+ 330.20502 182.7
[M]- 330.20612 182.7
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.