CID 208731

1-(2,2,4,4-tetramethylvaleryl)urea

Structural Information

Molecular Formula
C10H20N2O2
SMILES
CC(C)(C)CC(C)(C)C(=O)NC(=O)N
InChI
InChI=1S/C10H20N2O2/c1-9(2,3)6-10(4,5)7(13)12-8(11)14/h6H2,1-5H3,(H3,11,12,13,14)
InChIKey
STPKMNBMTCONTN-UHFFFAOYSA-N
Compound name
N-carbamoyl-2,2,4,4-tetramethylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.15248 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.15976 148.7
[M+Na]+ 223.14170 154.5
[M+NH4]+ 218.18630 153.9
[M+K]+ 239.11564 152.7
[M-H]- 199.14520 146.2
[M+Na-2H]- 221.12715 149.6
[M]+ 200.15193 148.4
[M]- 200.15303 148.4
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.