CID 44129642

2-[(2-methoxy-5-methylphenoxy)methyl]pyridine

Structural Information

Molecular Formula
C14H15NO2
SMILES
CC1=CC(=C(C=C1)OC)OCC2=CC=CC=N2
InChI
InChI=1S/C14H15NO2/c1-11-6-7-13(16-2)14(9-11)17-10-12-5-3-4-8-15-12/h3-9H,10H2,1-2H3
InChIKey
AVXQTLSOXWQOHO-UHFFFAOYSA-N
Compound name
2-[(2-methoxy-5-methylphenoxy)methyl]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

229.11028 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.11756 150.6
[M+Na]+ 252.09950 159.0
[M-H]- 228.10300 156.2
[M+NH4]+ 247.14410 167.4
[M+K]+ 268.07344 156.1
[M+H-H2O]+ 212.10754 142.3
[M+HCOO]- 274.10848 174.1
[M+CH3COO]- 288.12413 191.0
[M+Na-2H]- 250.08495 157.3
[M]+ 229.10973 153.8
[M]- 229.11083 153.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe