CID 73433

2,5-dimethylpiperazine-1,4-diethanol

Structural Information

Molecular Formula
C10H22N2O2
SMILES
CC1CN(C(CN1CCO)C)CCO
InChI
InChI=1S/C10H22N2O2/c1-9-7-12(4-6-14)10(2)8-11(9)3-5-13/h9-10,13-14H,3-8H2,1-2H3
InChIKey
VVURKMSVSTUWJQ-UHFFFAOYSA-N
Compound name
2-[4-(2-hydroxyethyl)-2,5-dimethylpiperazin-1-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

70
Patents

202.16812 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.17540 150.6
[M+Na]+ 225.15734 156.4
[M-H]- 201.16084 148.1
[M+NH4]+ 220.20194 166.2
[M+K]+ 241.13128 153.9
[M+H-H2O]+ 185.16538 143.8
[M+HCOO]- 247.16632 165.1
[M+CH3COO]- 261.18197 183.2
[M+Na-2H]- 223.14279 152.0
[M]+ 202.16757 147.9
[M]- 202.16867 147.9
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