CID 78882

5205-93-6

Structural Information

Molecular Formula

C₉H₁₈N₂O

SMILES

CC(=C)C(=O)NCCCN(C)C

InChI

InChI=1S/C9H18N2O/c1-8(2)9(12)10-6-5-7-11(3)4/h1,5-7H2,2-4H3,(H,10,12)

InChIKey

GDFCSMCGLZFNFY-UHFFFAOYSA-N

Compound name

N-[3-(dimethylamino)propyl]-2-methylprop-2-enamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 22
References: 31282
Patents: 170.1419 Da
Monoisotopic Mass: 0.9
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]+	171.14918	142.0
[M+Na]+	193.13112	149.5
[M+NH4]+	188.17572	148.7
[M+K]+	209.10506	145.1
[M-H]-	169.13462	141.9
[M+Na-2H]-	191.11657	144.5
[M]+	170.14135	142.6
[M]-	170.14245	142.6

Literature stripe

literature stripe

Patent stripe

patents stripe