CID 12891

((p-phenylbenzyl)oxy)guanidine

Structural Information

Molecular Formula
C14H15N3O
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)CON=C(N)N
InChI
InChI=1S/C14H15N3O/c15-14(16)17-18-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10H2,(H4,15,16,17)
InChIKey
YAFAWKGEYJVRGG-UHFFFAOYSA-N
Compound name
2-[(4-phenylphenyl)methoxy]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.1215 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.12878 156.1
[M+Na]+ 264.11072 167.7
[M+NH4]+ 259.15532 164.2
[M+K]+ 280.08466 160.7
[M-H]- 240.11422 162.1
[M+Na-2H]- 262.09617 165.2
[M]+ 241.12095 159.2
[M]- 241.12205 159.2
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

patents stripe