CID 2733289

1069-08-5

Structural Information

Molecular Formula

C₄H₁₀Cl₂NP

SMILES

CCN(CC)P(Cl)Cl

InChI

InChI=1S/C4H10Cl2NP/c1-3-7(4-2)8(5)6/h3-4H2,1-2H3

InChIKey

BPEMCEULJQTJMI-UHFFFAOYSA-N

Compound name

N-dichlorophosphanyl-N-ethylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 349
Patents: 172.9928 Da
Monoisotopic Mass: 2.5
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]+	174.00008	133.9
[M+Na]+	195.98202	142.0
[M-H]-	171.98552	134.2
[M+NH4]+	191.02662	156.6
[M+K]+	211.95596	139.7
[M+H-H2O]+	155.99006	129.0
[M+HCOO]-	217.99100	154.4
[M+CH3COO]-	232.00665	186.0
[M+Na-2H]-	193.96747	135.5
[M]+	172.99225	138.7
[M]-	172.99335	138.7

Literature stripe

literature stripe

Patent stripe

patents stripe