CID 208429

32150-61-1

Structural Information

Molecular Formula
C16H19N3O2
SMILES
CC1=C(C(=O)N(C(=O)N1C2=CC=CC=C2)C)N3CCCC3
InChI
InChI=1S/C16H19N3O2/c1-12-14(18-10-6-7-11-18)15(20)17(2)16(21)19(12)13-8-4-3-5-9-13/h3-5,8-9H,6-7,10-11H2,1-2H3
InChIKey
VYMMCESYBCZZER-UHFFFAOYSA-N
Compound name
3,6-dimethyl-1-phenyl-5-pyrrolidin-1-ylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.14774 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.155016 166.1
[M+Na]+ 308.136958 176.0
[M-H]- 284.140464 172.7
[M+NH4]+ 303.181563 179.8
[M+K]+ 324.110898 170.8
[M+H-H2O]+ 268.145000 156.2
[M+HCOO]- 330.145941 185.7
[M+CH3COO]- 344.161591 177.8
[M+Na-2H]- 306.122406 166.8
[M]+ 285.14719142 166.1
[M]- 285.14828858 166.1
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.