CID 22218523

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

Structural Information

Molecular Formula
C10H22N2O
SMILES
CCN1CCN(CC1)CCCCO
InChI
InChI=1S/C10H22N2O/c1-2-11-6-8-12(9-7-11)5-3-4-10-13/h13H,2-10H2,1H3
InChIKey
QNINQNAGDRKECY-UHFFFAOYSA-N
Compound name
4-(4-ethylpiperazin-1-yl)butan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

186.17322 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.18050 147.1
[M+Na]+ 209.16244 151.4
[M-H]- 185.16594 145.2
[M+NH4]+ 204.20704 163.5
[M+K]+ 225.13638 149.4
[M+H-H2O]+ 169.17048 139.6
[M+HCOO]- 231.17142 163.0
[M+CH3COO]- 245.18707 181.3
[M+Na-2H]- 207.14789 150.4
[M]+ 186.17267 144.0
[M]- 186.17377 144.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe