CID 116088

63981-34-0

Structural Information

Molecular Formula
C14H23N3O2
SMILES
CC1=C(C(=O)N(C(=O)N1C)C2CCCCC2)N(C)C
InChI
InChI=1S/C14H23N3O2/c1-10-12(15(2)3)13(18)17(14(19)16(10)4)11-8-6-5-7-9-11/h11H,5-9H2,1-4H3
InChIKey
ZWOWADWBRZWDLC-UHFFFAOYSA-N
Compound name
3-cyclohexyl-5-(dimethylamino)-1,6-dimethylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.17902 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.186296 161.4
[M+Na]+ 288.168238 169.4
[M-H]- 264.171744 167.0
[M+NH4]+ 283.212843 176.3
[M+K]+ 304.142178 167.0
[M+H-H2O]+ 248.176280 152.6
[M+HCOO]- 310.177221 181.0
[M+CH3COO]- 324.192871 205.3
[M+Na-2H]- 286.153686 162.6
[M]+ 265.17847142 161.2
[M]- 265.17956858 161.2
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.