CID 6453365

56611-54-2

Structural Information

Molecular Formula
C11H18N4O2
SMILES
CNC1=NC(=O)N(C(=O)N1C)C2CCCCC2
InChI
InChI=1S/C11H18N4O2/c1-12-9-13-10(16)15(11(17)14(9)2)8-6-4-3-5-7-8/h8H,3-7H2,1-2H3,(H,12,13,16)
InChIKey
YCIQIUHJVFRTTB-UHFFFAOYSA-N
Compound name
3-cyclohexyl-1-methyl-6-(methylamino)-1,3,5-triazine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

2
Patents

238.14297 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.15025 154.7
[M+Na]+ 261.13219 162.9
[M-H]- 237.13569 157.5
[M+NH4]+ 256.17679 168.2
[M+K]+ 277.10613 159.4
[M+H-H2O]+ 221.14023 145.3
[M+HCOO]- 283.14117 173.4
[M+CH3COO]- 297.15682 194.5
[M+Na-2H]- 259.11764 158.7
[M]+ 238.14242 152.2
[M]- 238.14352 152.2
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.