CID 202712

Urea, (2,2-dimethylvaleryl)-

Structural Information

Molecular Formula
C8H16N2O2
SMILES
CCCC(C)(C)C(=O)NC(=O)N
InChI
InChI=1S/C8H16N2O2/c1-4-5-8(2,3)6(11)10-7(9)12/h4-5H2,1-3H3,(H3,9,10,11,12)
InChIKey
GKFQYYGALVVKKQ-UHFFFAOYSA-N
Compound name
N-carbamoyl-2,2-dimethylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

172.12119 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.12847 140.3
[M+Na]+ 195.11041 146.7
[M+NH4]+ 190.15501 145.9
[M+K]+ 211.08435 144.1
[M-H]- 171.11391 138.4
[M+Na-2H]- 193.09586 141.7
[M]+ 172.12064 140.1
[M]- 172.12174 140.1
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

patents stripe