CID 261286

1,4-piperazinedipropanol

Structural Information

Molecular Formula
C10H22N2O2
SMILES
C1CN(CCN1CCCO)CCCO
InChI
InChI=1S/C10H22N2O2/c13-9-1-3-11-5-7-12(8-6-11)4-2-10-14/h13-14H,1-10H2
InChIKey
QGTJMDUCAZVEHU-UHFFFAOYSA-N
Compound name
3-[4-(3-hydroxypropyl)piperazin-1-yl]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

200
Patents

202.16812 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.17540 149.6
[M+Na]+ 225.15734 158.4
[M+NH4]+ 220.20194 155.9
[M+K]+ 241.13128 152.9
[M-H]- 201.16084 148.6
[M+Na-2H]- 223.14279 152.0
[M]+ 202.16757 150.1
[M]- 202.16867 150.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe