CID 3052316

Urea, (bis(dimethylamino)methylene)(2,6-diethylphenyl)-, monohydrochloride

Structural Information

Molecular Formula
C16H26N4O
SMILES
CCC1=C(C(=CC=C1)CC)NC(=O)N=C(N(C)C)N(C)C
InChI
InChI=1S/C16H26N4O/c1-7-12-10-9-11-13(8-2)14(12)17-15(21)18-16(19(3)4)20(5)6/h9-11H,7-8H2,1-6H3,(H,17,21)
InChIKey
OULBHJLIOINHOK-UHFFFAOYSA-N
Compound name
1-[bis(dimethylamino)methylidene]-3-(2,6-diethylphenyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.21066 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.21794 174.5
[M+Na]+ 313.19988 182.5
[M+NH4]+ 308.24448 180.8
[M+K]+ 329.17382 177.3
[M-H]- 289.20338 178.3
[M+Na-2H]- 311.18533 179.1
[M]+ 290.21011 176.3
[M]- 290.21121 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.