CID 40238

Brn 0929204

Structural Information

Molecular Formula
C16H25N3O3
SMILES
CC(CC1(C(=O)NC(=O)NC1=O)CC=C)NC2CCCCC2
InChI
InChI=1S/C16H25N3O3/c1-3-9-16(13(20)18-15(22)19-14(16)21)10-11(2)17-12-7-5-4-6-8-12/h3,11-12,17H,1,4-10H2,2H3,(H2,18,19,20,21,22)
InChIKey
AMNCJCPIBOZGHF-UHFFFAOYSA-N
Compound name
5-[2-(cyclohexylamino)propyl]-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

307.1896 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.19688 175.7
[M+Na]+ 330.17882 182.3
[M+NH4]+ 325.22342 181.1
[M+K]+ 346.15276 175.9
[M-H]- 306.18232 175.3
[M+Na-2H]- 328.16427 177.8
[M]+ 307.18905 175.9
[M]- 307.19015 175.9
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.