CID 55299566

1940166-68-6

Structural Information

Molecular Formula

C₇H₁₆N₂O

SMILES

CC(C)(C1CNCCN1)O

InChI

InChI=1S/C7H16N2O/c1-7(2,10)6-5-8-3-4-9-6/h6,8-10H,3-5H2,1-2H3

InChIKey

XGAXJTWDJSHRBT-UHFFFAOYSA-N

Compound name

2-piperazin-2-ylpropan-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 40
Patents: 144.12627 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]+	145.13355	136.0
[M+Na]+	167.11549	140.3
[M-H]-	143.11899	131.8
[M+NH4]+	162.16009	152.4
[M+K]+	183.08943	137.6
[M+H-H2O]+	127.12353	130.1
[M+HCOO]-	189.12447	148.2
[M+CH3COO]-	203.14012	166.3
[M+Na-2H]-	165.10094	141.2
[M]+	144.12572	127.2
[M]-	144.12682	127.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe