CID 231184

1-(2-hydroxyethyl)-4-methylpiperazine

Structural Information

Molecular Formula
C7H16N2O
SMILES
CN1CCN(CC1)CCO
InChI
InChI=1S/C7H16N2O/c1-8-2-4-9(5-3-8)6-7-10/h10H,2-7H2,1H3
InChIKey
QHTUMQYGZQYEOZ-UHFFFAOYSA-N
Compound name
2-(4-methylpiperazin-1-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4942
Patents

144.12627 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.13355 133.7
[M+Na]+ 167.11549 139.4
[M-H]- 143.11899 132.4
[M+NH4]+ 162.16009 151.8
[M+K]+ 183.08943 138.1
[M+H-H2O]+ 127.12353 126.8
[M+HCOO]- 189.12447 150.6
[M+CH3COO]- 203.14012 172.2
[M+Na-2H]- 165.10094 138.6
[M]+ 144.12572 129.5
[M]- 144.12682 129.5
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