CID 2734844

2-cyanoethyl n,n-diisopropylchlorophosphoramidite

Structural Information

Molecular Formula

C₉H₁₈ClN₂OP

SMILES

CC(C)N(C(C)C)P(OCCC#N)Cl

InChI

InChI=1S/C9H18ClN2OP/c1-8(2)12(9(3)4)14(10)13-7-5-6-11/h8-9H,5,7H2,1-4H3

InChIKey

QWTBDIBOOIAZEF-UHFFFAOYSA-N

Compound name

3-[chloro-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 3
References: 5403
Patents: 236.08453 Da
Monoisotopic Mass: 2.3
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]+	237.091806	147.5
[M+Na]+	259.073748	154.8
[M-H]-	235.077254	148.4
[M+NH4]+	254.118353	165.4
[M+K]+	275.047688	154.2
[M+H-H2O]+	219.081790	134.7
[M+HCOO]-	281.082731	166.9
[M+CH3COO]-	295.098381	211.3
[M+Na-2H]-	257.059196	146.1
[M]+	236.08398142	148.3
[M]-	236.08507858	148.3

Literature stripe

literature stripe

Patent stripe

patents stripe