CID 26646

14357-94-9

Structural Information

Molecular Formula
C15H20N2O3
SMILES
CC1(C(=O)N(C(=O)N(C1=O)CC=C)C)C2=CCCCC2
InChI
InChI=1S/C15H20N2O3/c1-4-10-17-13(19)15(2,11-8-6-5-7-9-11)12(18)16(3)14(17)20/h4,8H,1,5-7,9-10H2,2-3H3
InChIKey
RANMOJITRAFCCT-UHFFFAOYSA-N
Compound name
5-(cyclohexen-1-yl)-1,5-dimethyl-3-prop-2-enyl-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.1474 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.154676 162.6
[M+Na]+ 299.136618 170.3
[M-H]- 275.140124 166.3
[M+NH4]+ 294.181223 178.3
[M+K]+ 315.110558 166.7
[M+H-H2O]+ 259.144660 155.0
[M+HCOO]- 321.145601 178.1
[M+CH3COO]- 335.161251 200.7
[M+Na-2H]- 297.122066 163.2
[M]+ 276.14685142 159.8
[M]- 276.14794858 159.8
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.