CID 4111950

4-phenyl-1-(p-tolyl)semicarbazide

Structural Information

Molecular Formula
C14H15N3O
SMILES
CC1=CC=C(C=C1)NNC(=O)NC2=CC=CC=C2
InChI
InChI=1S/C14H15N3O/c1-11-7-9-13(10-8-11)16-17-14(18)15-12-5-3-2-4-6-12/h2-10,16H,1H3,(H2,15,17,18)
InChIKey
PTPUGNZEEMRUKX-UHFFFAOYSA-N
Compound name
1-(4-methylanilino)-3-phenylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.1215 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.12878 156.4
[M+Na]+ 264.11072 168.1
[M+NH4]+ 259.15532 164.5
[M+K]+ 280.08466 160.9
[M-H]- 240.11422 162.3
[M+Na-2H]- 262.09617 165.9
[M]+ 241.12095 159.5
[M]- 241.12205 159.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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No patent data available for this compound.