CID 541623

3-hydroxy-n,n-dimethylpropanamide

Structural Information

Molecular Formula

C₅H₁₁NO₂

SMILES

CN(C)C(=O)CCO

InChI

InChI=1S/C5H11NO2/c1-6(2)5(8)3-4-7/h7H,3-4H2,1-2H3

InChIKey

ZEVPZBDCQLTDHD-UHFFFAOYSA-N

Compound name

3-hydroxy-N,N-dimethylpropanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 548
Patents: 117.07898 Da
Monoisotopic Mass: -1.0
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]+	118.08626	123.9
[M+Na]+	140.06820	130.6
[M-H]-	116.07170	124.5
[M+NH4]+	135.11280	146.3
[M+K]+	156.04214	131.9
[M+H-H2O]+	100.07624	119.3
[M+HCOO]-	162.07718	147.8
[M+CH3COO]-	176.09283	173.0
[M+Na-2H]-	138.05365	129.2
[M]+	117.07843	124.8
[M]-	117.07953	124.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe