CID 65618

Amoxydramine

Structural Information

Molecular Formula

C₁₇H₂₁NO₂

SMILES

C[N+](C)(CCOC(C1=CC=CC=C1)C2=CC=CC=C2)[O-]

InChI

InChI=1S/C17H21NO2/c1-18(2,19)13-14-20-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3

InChIKey

OEQNVWKWQPTBSC-UHFFFAOYSA-N

Compound name

2-benzhydryloxy-N,N-dimethylethanamine oxide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 14
Patents: 271.15723 Da
Monoisotopic Mass: 2.7
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]+	272.16451	163.0
[M+Na]+	294.14645	167.0
[M-H]-	270.14995	168.9
[M+NH4]+	289.19105	178.3
[M+K]+	310.12039	159.5
[M+H-H2O]+	254.15449	159.9
[M+HCOO]-	316.15543	185.6
[M+CH3COO]-	330.17108	194.1
[M+Na-2H]-	292.13190	171.2
[M]+	271.15668	161.9
[M]-	271.15778	161.9

Literature stripe

literature stripe

Patent stripe

patents stripe