CID 208421

32150-40-6

Structural Information

Molecular Formula
C13H21N3O2
SMILES
CC1=C(C(=O)NC(=O)N1C2CCCCC2)N(C)C
InChI
InChI=1S/C13H21N3O2/c1-9-11(15(2)3)12(17)14-13(18)16(9)10-7-5-4-6-8-10/h10H,4-8H2,1-3H3,(H,14,17,18)
InChIKey
MSDZXGWQPGEHBJ-UHFFFAOYSA-N
Compound name
1-cyclohexyl-5-(dimethylamino)-6-methylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.16338 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.17066 157.9
[M+Na]+ 274.15260 164.9
[M-H]- 250.15610 161.9
[M+NH4]+ 269.19720 172.2
[M+K]+ 290.12654 161.8
[M+H-H2O]+ 234.16064 149.2
[M+HCOO]- 296.16158 176.3
[M+CH3COO]- 310.17723 198.6
[M+Na-2H]- 272.13805 159.8
[M]+ 251.16283 155.1
[M]- 251.16393 155.1
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.