CID 92978713

(2s)-2-(methoxymethyl)piperazine

Structural Information

Molecular Formula

C₆H₁₄N₂O

SMILES

COC[C@@H]1CNCCN1

InChI

InChI=1S/C6H14N2O/c1-9-5-6-4-7-2-3-8-6/h6-8H,2-5H2,1H3/t6-/m0/s1

InChIKey

VSKJXHRGVSZNRH-LURJTMIESA-N

Compound name

(2S)-2-(methoxymethyl)piperazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 130.11061 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]+	131.117886	130.1
[M+Na]+	153.099828	134.8
[M-H]-	129.103334	127.1
[M+NH4]+	148.144433	147.7
[M+K]+	169.073768	132.8
[M+H-H2O]+	113.107870	123.3
[M+HCOO]-	175.108811	145.8
[M+CH3COO]-	189.124461	165.5
[M+Na-2H]-	151.085276	135.7
[M]+	130.11006142	123.2
[M]-	130.11115858	123.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe