CID 3040358

1,1-dibutyl-3-ethylurea

Structural Information

Molecular Formula
C11H24N2O
SMILES
CCCCN(CCCC)C(=O)NCC
InChI
InChI=1S/C11H24N2O/c1-4-7-9-13(10-8-5-2)11(14)12-6-3/h4-10H2,1-3H3,(H,12,14)
InChIKey
RIYAGGMGJVGXPG-UHFFFAOYSA-N
Compound name
1,1-dibutyl-3-ethylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

200.18886 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.19614 151.3
[M+Na]+ 223.17808 158.8
[M+NH4]+ 218.22268 158.1
[M+K]+ 239.15202 153.1
[M-H]- 199.18158 151.6
[M+Na-2H]- 221.16353 153.8
[M]+ 200.18831 152.0
[M]- 200.18941 152.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe