CID 3021404

1-amino-3-(cyclooctyloxy)-2-propanol

Structural Information

Molecular Formula
C11H23NO2
SMILES
C1CCCC(CCC1)OCC(CN)O
InChI
InChI=1S/C11H23NO2/c12-8-10(13)9-14-11-6-4-2-1-3-5-7-11/h10-11,13H,1-9,12H2
InChIKey
WPXCHYJOFMZFSC-UHFFFAOYSA-N
Compound name
1-amino-3-cyclooctyloxypropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.17288 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.18016 143.7
[M+Na]+ 224.16210 146.1
[M+NH4]+ 219.20670 146.2
[M+K]+ 240.13604 146.0
[M-H]- 200.16560 144.1
[M+Na-2H]- 222.14755 146.2
[M]+ 201.17233 143.9
[M]- 201.17343 143.9
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

No patent data available for this compound.