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]+ 252.170656 157.9
[M+Na]+ 274.152598 164.9
[M-H]- 250.156104 161.9
[M+NH4]+ 269.197203 172.2
[M+K]+ 290.126538 161.8
[M+H-H2O]+ 234.160640 149.2
[M+HCOO]- 296.161581 176.3
[M+CH3COO]- 310.177231 198.6
[M+Na-2H]- 272.138046 159.8
[M]+ 251.16283142 155.1
[M]- 251.16392858 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.