CID 2759304

56323-03-6

Structural Information

Molecular Formula

C₉H₂₀N₂O

SMILES

CN1CCN(CC1)CCCCO

InChI

InChI=1S/C9H20N2O/c1-10-5-7-11(8-6-10)4-2-3-9-12/h12H,2-9H2,1H3

InChIKey

GSFOUKVQYFLTRA-UHFFFAOYSA-N

Compound name

4-(4-methylpiperazin-1-yl)butan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 252
Patents: 172.15756 Da
Monoisotopic Mass: 0.1
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]+	173.16484	141.8
[M+Na]+	195.14678	151.9
[M+NH4]+	190.19138	149.3
[M+K]+	211.12072	145.8
[M-H]-	171.15028	142.0
[M+Na-2H]-	193.13223	145.6
[M]+	172.15701	143.0
[M]-	172.15811	143.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe