CID 92297

N-nitrosophenmetrazine

Structural Information

Molecular Formula

C₁₁H₁₄N₂O₂

SMILES

CC1C(OCCN1N=O)C2=CC=CC=C2

InChI

InChI=1S/C11H14N2O2/c1-9-11(10-5-3-2-4-6-10)15-8-7-13(9)12-14/h2-6,9,11H,7-8H2,1H3

InChIKey

AUJFBAMBAVQREK-UHFFFAOYSA-N

Compound name

3-methyl-4-nitroso-2-phenylmorpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 206.10553 Da
Monoisotopic Mass: 2.1
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]+	207.11281	145.1
[M+Na]+	229.09475	158.2
[M+NH4]+	224.13935	153.6
[M+K]+	245.06869	151.7
[M-H]-	205.09825	150.8
[M+Na-2H]-	227.08020	152.8
[M]+	206.10498	148.5
[M]-	206.10608	148.5

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.