CID 10486878

205993-33-5

Structural Information

Molecular Formula

C₅H₁₀N₂O₂

SMILES

C1[C@@H](NC(=O)CN1)CO

InChI

InChI=1S/C5H10N2O2/c8-3-4-1-6-2-5(9)7-4/h4,6,8H,1-3H2,(H,7,9)/t4-/m1/s1

InChIKey

AOUYCCFUYHPVGG-SCSAIBSYSA-N

Compound name

(6R)-6-(hydroxymethyl)piperazin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 84
Patents: 130.07423 Da
Monoisotopic Mass: -1.7
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]+	131.08151	128.2
[M+Na]+	153.06345	134.1
[M-H]-	129.06695	124.4
[M+NH4]+	148.10805	145.2
[M+K]+	169.03739	131.3
[M+H-H2O]+	113.07149	122.1
[M+HCOO]-	175.07243	143.1
[M+CH3COO]-	189.08808	162.3
[M+Na-2H]-	151.04890	133.1
[M]+	130.07368	120.2
[M]-	130.07478	120.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe