CID 259090

Nsc88619

Structural Information

Molecular Formula

C₁₀H₂₂N₂O₂

SMILES

CN(C)CC1C(CCCN1CCO)O

InChI

InChI=1S/C10H22N2O2/c1-11(2)8-9-10(14)4-3-5-12(9)6-7-13/h9-10,13-14H,3-8H2,1-2H3

InChIKey

VXJLLDYPQBOSOV-UHFFFAOYSA-N

Compound name

2-[(dimethylamino)methyl]-1-(2-hydroxyethyl)piperidin-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 202.16812 Da
Monoisotopic Mass: -0.4
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]+	203.17540	149.1
[M+Na]+	225.15734	153.2
[M-H]-	201.16084	149.1
[M+NH4]+	220.20194	166.1
[M+K]+	241.13128	152.2
[M+H-H2O]+	185.16538	142.4
[M+HCOO]-	247.16632	166.6
[M+CH3COO]-	261.18197	187.6
[M+Na-2H]-	223.14279	150.9
[M]+	202.16757	145.9
[M]-	202.16867	145.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe