CID 57295

97703-22-5

Structural Information

Molecular Formula
C16H26N4O3
SMILES
CC1=C(C(=O)N(C(=O)N1C)C2CCCCC2)NC(=O)CN(C)C
InChI
InChI=1S/C16H26N4O3/c1-11-14(17-13(21)10-18(2)3)15(22)20(16(23)19(11)4)12-8-6-5-7-9-12/h12H,5-10H2,1-4H3,(H,17,21)
InChIKey
OAFPWHLDJSULGE-UHFFFAOYSA-N
Compound name
N-(1-cyclohexyl-3,4-dimethyl-2,6-dioxopyrimidin-5-yl)-2-(dimethylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.2005 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.20778 176.4
[M+Na]+ 345.18972 182.5
[M-H]- 321.19322 181.7
[M+NH4]+ 340.23432 188.3
[M+K]+ 361.16366 180.2
[M+H-H2O]+ 305.19776 166.9
[M+HCOO]- 367.19870 195.8
[M+CH3COO]- 381.21435 218.3
[M+Na-2H]- 343.17517 176.1
[M]+ 322.19995 176.3
[M]- 322.20105 176.3
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.