CID 104564081

1918293-24-9

Structural Information

Molecular Formula
C13H21NO5
SMILES
COCCOCCOCCOC1=CN=C(C=C1)CO
InChI
InChI=1S/C13H21NO5/c1-16-4-5-17-6-7-18-8-9-19-13-3-2-12(11-15)14-10-13/h2-3,10,15H,4-9,11H2,1H3
InChIKey
PAPBDQPVTNQBCJ-UHFFFAOYSA-N
Compound name
[5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridin-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

271.14197 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.14925 162.5
[M+Na]+ 294.13119 172.8
[M+NH4]+ 289.17579 167.9
[M+K]+ 310.10513 167.1
[M-H]- 270.13469 161.8
[M+Na-2H]- 292.11664 166.5
[M]+ 271.14142 163.4
[M]- 271.14252 163.4
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