CID 3051902

N-(2-(dimethylamino)-1-methylethyl)-n'-(3,4,5-trimethoxyphenyl)urea

Structural Information

Molecular Formula
C15H25N3O4
SMILES
CC(CN(C)C)NC(=O)NC1=CC(=C(C(=C1)OC)OC)OC
InChI
InChI=1S/C15H25N3O4/c1-10(9-18(2)3)16-15(19)17-11-7-12(20-4)14(22-6)13(8-11)21-5/h7-8,10H,9H2,1-6H3,(H2,16,17,19)
InChIKey
LGZMBIKTQDTVRA-UHFFFAOYSA-N
Compound name
1-[1-(dimethylamino)propan-2-yl]-3-(3,4,5-trimethoxyphenyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.1845 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.191776 174.8
[M+Na]+ 334.173718 179.4
[M-H]- 310.177224 179.7
[M+NH4]+ 329.218323 189.6
[M+K]+ 350.147658 180.4
[M+H-H2O]+ 294.181760 166.6
[M+HCOO]- 356.182701 199.9
[M+CH3COO]- 370.198351 219.4
[M+Na-2H]- 332.159166 175.4
[M]+ 311.18395142 180.5
[M]- 311.18504858 180.5
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.