CID 46867

Heptyldichlorarsine

Structural Information

Molecular Formula

C₇H₁₅AsCl₂

SMILES

CCCCCCC[As](Cl)Cl

InChI

InChI=1S/C7H15AsCl2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3

InChIKey

DTEQYCHDTQLFAV-UHFFFAOYSA-N

Compound name

dichloro(heptyl)arsane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 243.97667 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]+	244.98395	150.6
[M+Na]+	266.96589	157.4
[M-H]-	242.96939	149.2
[M+NH4]+	262.01049	171.3
[M+K]+	282.93983	152.9
[M+H-H2O]+	226.97393	147.0
[M+HCOO]-	288.97487	162.5
[M+CH3COO]-	302.99052	185.0
[M+Na-2H]-	264.95134	153.0
[M]+	243.97612	154.5
[M]-	243.97722	154.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe