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
2
Annotation Hits

0
References

10
Patents

165.11537 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.122646 136.1
[M+Na]+ 188.104588 143.1
[M-H]- 164.108094 137.9
[M+NH4]+ 183.149193 155.4
[M+K]+ 204.078528 141.4
[M+H-H2O]+ 148.112630 129.2
[M+HCOO]- 210.113571 159.3
[M+CH3COO]- 224.129221 179.1
[M+Na-2H]- 186.090036 143.9
[M]+ 165.11482142 138.3
[M]- 165.11591858 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