CID 969777

Acetamide, 2-(diethylamino)-n-(phenylmethyl)-

Structural Information

Molecular Formula

C₁₃H₂₀N₂O

SMILES

CCN(CC)CC(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C13H20N2O/c1-3-15(4-2)11-13(16)14-10-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,14,16)

InChIKey

CUMDOJBQHHXABV-UHFFFAOYSA-N

Compound name

N-benzyl-2-(diethylamino)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 3
Patents: 220.15756 Da
Monoisotopic Mass: 2.1
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]+	221.164836	153.4
[M+Na]+	243.146778	157.6
[M-H]-	219.150284	157.7
[M+NH4]+	238.191383	171.7
[M+K]+	259.120718	156.4
[M+H-H2O]+	203.154820	146.0
[M+HCOO]-	265.155761	178.6
[M+CH3COO]-	279.171411	198.0
[M+Na-2H]-	241.132226	158.0
[M]+	220.15701142	154.5
[M]-	220.15810858	154.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe