CID 79153158

1-(3-aminophenyl)-1,3,3-trimethylurea

Structural Information

Molecular Formula
C10H15N3O
SMILES
CN(C)C(=O)N(C)C1=CC=CC(=C1)N
InChI
InChI=1S/C10H15N3O/c1-12(2)10(14)13(3)9-6-4-5-8(11)7-9/h4-7H,11H2,1-3H3
InChIKey
KVRGVFCXVNNRQI-UHFFFAOYSA-N
Compound name
1-(3-aminophenyl)-1,3,3-trimethylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.1215 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.12878 144.2
[M+Na]+ 216.11072 153.8
[M+NH4]+ 211.15532 152.1
[M+K]+ 232.08466 149.4
[M-H]- 192.11422 147.8
[M+Na-2H]- 214.09617 150.5
[M]+ 193.12095 146.3
[M]- 193.12205 146.3
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.