CID 9793833

N,n-bis(2-hydroxyethyl)acetamide

Structural Information

Molecular Formula

C₆H₁₃NO₃

SMILES

CC(=O)N(CCO)CCO

InChI

InChI=1S/C6H13NO3/c1-6(10)7(2-4-8)3-5-9/h8-9H,2-5H2,1H3

InChIKey

CSSWCWIUAZSBHV-UHFFFAOYSA-N

Compound name

N,N-bis(2-hydroxyethyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 392
Patents: 147.08954 Da
Monoisotopic Mass: -1.6
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]+	148.09682	132.1
[M+Na]+	170.07876	137.8
[M-H]-	146.08226	131.0
[M+NH4]+	165.12336	152.4
[M+K]+	186.05270	138.3
[M+H-H2O]+	130.08680	127.1
[M+HCOO]-	192.08774	154.3
[M+CH3COO]-	206.10339	175.4
[M+Na-2H]-	168.06421	136.2
[M]+	147.08899	132.8
[M]-	147.09009	132.8

Literature stripe

literature stripe

Patent stripe

patents stripe