CID 11600674

89209-12-1

Structural Information

Molecular Formula

C₆H₁₃NO₂

SMILES

C[C@@H](CC(=O)N(C)C)O

InChI

InChI=1S/C6H13NO2/c1-5(8)4-6(9)7(2)3/h5,8H,4H2,1-3H3/t5-/m0/s1

InChIKey

OHICCAZEETWRET-YFKPBYRVSA-N

Compound name

(3S)-3-hydroxy-N,N-dimethylbutanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 131.09464 Da
Monoisotopic Mass: -0.6
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]+	132.10192	128.8
[M+Na]+	154.08386	134.9
[M-H]-	130.08736	129.4
[M+NH4]+	149.12846	150.5
[M+K]+	170.05780	136.3
[M+H-H2O]+	114.09190	124.0
[M+HCOO]-	176.09284	151.4
[M+CH3COO]-	190.10849	176.9
[M+Na-2H]-	152.06931	132.3
[M]+	131.09409	129.4
[M]-	131.09519	129.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe