CID 12907

(diphenylmethoxy)guanidine nitrate

Structural Information

Molecular Formula

C₁₄H₁₅N₃O

SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)ON=C(N)N

InChI

InChI=1S/C14H15N3O/c15-14(16)17-18-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H,(H4,15,16,17)

InChIKey

ZGLBAWURMICCEQ-UHFFFAOYSA-N

Compound name

2-benzhydryloxyguanidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 241.1215 Da
Monoisotopic Mass: 2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	242.12878	156.4
[M+Na]+	264.11072	167.2
[M+NH4]+	259.15532	164.4
[M+K]+	280.08466	160.8
[M-H]-	240.11422	162.1
[M+Na-2H]-	262.09617	165.4
[M]+	241.12095	159.3
[M]-	241.12205	159.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe