CID 7010344

2-(dimethylamino)acetyl chloride hydrochloride

Structural Information

Molecular Formula

SMILES

CN(C)CC(=O)Cl

InChI

InChI=1S/C4H8ClNO/c1-6(2)3-4(5)7/h3H2,1-2H3

InChIKey

VTYRPALGSNDUQQ-UHFFFAOYSA-N

Compound name

2-(dimethylamino)acetyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1889
Patents: 121.02944 Da
Monoisotopic Mass: 0.8
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]+	122.03672	121.0
[M+Na]+	144.01866	129.2
[M-H]-	120.02216	123.1
[M+NH4]+	139.06326	144.7
[M+K]+	159.99260	129.0
[M+H-H2O]+	104.02670	117.5
[M+HCOO]-	166.02764	141.9
[M+CH3COO]-	180.04329	175.3
[M+Na-2H]-	142.00411	127.0
[M]+	121.02889	123.9
[M]-	121.02999	123.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.