CID 135599715

Urea, 1-(p-aminophenyl)-3-ethylamino-, dihydrochloride

Structural Information

Molecular Formula
C10H15N5O
SMILES
CCN/N=C/NC(=O)NC1=CC=C(C=C1)N
InChI
InChI=1S/C10H15N5O/c1-2-13-14-7-12-10(16)15-9-5-3-8(11)4-6-9/h3-7,13H,2,11H2,1H3,(H2,12,14,15,16)
InChIKey
WQVBKAYAZKYVTI-UHFFFAOYSA-N
Compound name
1-(4-aminophenyl)-3-[(E)-(ethylhydrazinylidene)methyl]urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.12766 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.134936 147.4
[M+Na]+ 244.116878 151.9
[M-H]- 220.120384 151.9
[M+NH4]+ 239.161483 164.5
[M+K]+ 260.090818 150.2
[M+H-H2O]+ 204.124920 139.2
[M+HCOO]- 266.125861 177.1
[M+CH3COO]- 280.141511 202.1
[M+Na-2H]- 242.102326 154.1
[M]+ 221.12711142 144.2
[M]- 221.12820858 144.2
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.