CID 24690825

2-amino-n-(2,2,2-trifluoroethyl)propanamide hydrochloride

Structural Information

Molecular Formula

C₅H₉F₃N₂O

SMILES

CC(C(=O)NCC(F)(F)F)N

InChI

InChI=1S/C5H9F3N2O/c1-3(9)4(11)10-2-5(6,7)8/h3H,2,9H2,1H3,(H,10,11)

InChIKey

HUMQBXRKDQYSTI-UHFFFAOYSA-N

Compound name

2-amino-N-(2,2,2-trifluoroethyl)propanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 23
Patents: 170.0667 Da
Monoisotopic Mass: 0.1
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]+	171.07398	135.7
[M+Na]+	193.05592	140.2
[M+NH4]+	188.10052	139.9
[M+K]+	209.02986	137.9
[M-H]-	169.05942	130.3
[M+Na-2H]-	191.04137	136.2
[M]+	170.06615	134.1
[M]-	170.06725	134.1

Literature stripe

literature stripe

Patent stripe

patents stripe