CID 112444

2-(2-propoxyethyl)pyridine

Structural Information

Molecular Formula
C10H15NO
SMILES
CCCOCCC1=CC=CC=N1
InChI
InChI=1S/C10H15NO/c1-2-8-12-9-6-10-5-3-4-7-11-10/h3-5,7H,2,6,8-9H2,1H3
InChIKey
ZLJMIUFTLBIOEK-UHFFFAOYSA-N
Compound name
2-(2-propoxyethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

165.11537 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.12265 136.1
[M+Na]+ 188.10459 143.1
[M-H]- 164.10809 137.9
[M+NH4]+ 183.14919 155.4
[M+K]+ 204.07853 141.4
[M+H-H2O]+ 148.11263 129.2
[M+HCOO]- 210.11357 159.3
[M+CH3COO]- 224.12922 179.1
[M+Na-2H]- 186.09004 143.9
[M]+ 165.11482 138.3
[M]- 165.11592 138.3
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