CID 44145149

180982-91-6

Structural Information

Molecular Formula
C13H27NO3
SMILES
CCCCCCCCOCCCNC(=O)CO
InChI
InChI=1S/C13H27NO3/c1-2-3-4-5-6-7-10-17-11-8-9-14-13(16)12-15/h15H,2-12H2,1H3,(H,14,16)
InChIKey
KFVKGCFXEKFSJU-UHFFFAOYSA-N
Compound name
2-hydroxy-N-(3-octoxypropyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.1991 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.20638 162.0
[M+Na]+ 268.18832 168.5
[M+NH4]+ 263.23292 167.1
[M+K]+ 284.16226 162.9
[M-H]- 244.19182 159.9
[M+Na-2H]- 266.17377 162.4
[M]+ 245.19855 161.8
[M]- 245.19965 161.8
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.