CID 202940

O-phenethylhydroxylamine hydrochloride

Structural Information

Molecular Formula

SMILES

C1=CC=C(C=C1)CCON

InChI

InChI=1S/C8H11NO/c9-10-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2

InChIKey

BZCDKOOXCPRISF-UHFFFAOYSA-N

Compound name

O-(2-phenylethyl)hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 278
Patents: 137.08406 Da
Monoisotopic Mass: 1.4
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]+	138.09134	127.2
[M+Na]+	160.07328	139.3
[M+NH4]+	155.11788	136.4
[M+K]+	176.04722	132.6
[M-H]-	136.07678	130.2
[M+Na-2H]-	158.05873	135.0
[M]+	137.08351	129.7
[M]-	137.08461	129.7

Literature stripe

literature stripe

Patent stripe

patents stripe