CID 14511499

145842-51-9

Structural Information

Molecular Formula

C₅H₁₁NO₂

SMILES

C[C@H](CO)NC(=O)C

InChI

InChI=1S/C5H11NO2/c1-4(3-7)6-5(2)8/h4,7H,3H2,1-2H3,(H,6,8)/t4-/m1/s1

InChIKey

LFVBTAFBWUVUHV-SCSAIBSYSA-N

Compound name

N-[(2R)-1-hydroxypropan-2-yl]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 26
Patents: 117.07898 Da
Monoisotopic Mass: -0.7
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	124.4
[M+Na]+	140.06820	132.7
[M+NH4]+	135.11280	131.4
[M+K]+	156.04214	129.3
[M-H]-	116.07170	123.0
[M+Na-2H]-	138.05365	127.0
[M]+	117.07843	124.7
[M]-	117.07953	124.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe