CID 2988282

Urea, n,n-dimethyl-n'-(3,4,5-trimethoxyphenyl)-

Structural Information

Molecular Formula
C12H18N2O4
SMILES
CN(C)C(=O)NC1=CC(=C(C(=C1)OC)OC)OC
InChI
InChI=1S/C12H18N2O4/c1-14(2)12(15)13-8-6-9(16-3)11(18-5)10(7-8)17-4/h6-7H,1-5H3,(H,13,15)
InChIKey
KBTUNDIMMHLQSM-UHFFFAOYSA-N
Compound name
1,1-dimethyl-3-(3,4,5-trimethoxyphenyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

254.12666 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.13394 156.3
[M+Na]+ 277.11588 163.5
[M-H]- 253.11938 161.9
[M+NH4]+ 272.16048 174.0
[M+K]+ 293.08982 164.5
[M+H-H2O]+ 237.12392 149.1
[M+HCOO]- 299.12486 182.5
[M+CH3COO]- 313.14051 204.2
[M+Na-2H]- 275.10133 159.5
[M]+ 254.12611 162.5
[M]- 254.12721 162.5
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

No patent data available for this compound.