CID 3045784

Ethylphenyldimethylaminoarsine

Structural Information

Molecular Formula

C₁₀H₁₆AsN

SMILES

CC[As](C1=CC=CC=C1)N(C)C

InChI

InChI=1S/C10H16AsN/c1-4-11(12(2)3)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3

InChIKey

PTKPOWIPOACTQE-UHFFFAOYSA-N

Compound name

N-[ethyl(phenyl)arsanyl]-N-methylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 225.04987 Da
Monoisotopic Mass: None
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]+	226.05715	149.1
[M+Na]+	248.03909	154.3
[M-H]-	224.04259	153.3
[M+NH4]+	243.08369	169.6
[M+K]+	264.01303	153.4
[M+H-H2O]+	208.04713	142.1
[M+HCOO]-	270.04807	172.9
[M+CH3COO]-	284.06372	188.8
[M+Na-2H]-	246.02454	153.4
[M]+	225.04932	149.6
[M]-	225.05042	149.6

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.