CID 2734304

2-(1,3,-dioxolan-2-yl)-6-methylpyridine

Structural Information

Molecular Formula
C9H11NO2
SMILES
CC1=NC(=CC=C1)C2OCCO2
InChI
InChI=1S/C9H11NO2/c1-7-3-2-4-8(10-7)9-11-5-6-12-9/h2-4,9H,5-6H2,1H3
InChIKey
BRLNLMMLCNZBNP-UHFFFAOYSA-N
Compound name
2-(1,3-dioxolan-2-yl)-6-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

165.07898 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.086256 132.3
[M+Na]+ 188.068198 140.0
[M-H]- 164.071704 138.8
[M+NH4]+ 183.112803 150.6
[M+K]+ 204.042138 140.8
[M+H-H2O]+ 148.076240 125.8
[M+HCOO]- 210.077181 153.5
[M+CH3COO]- 224.092831 146.4
[M+Na-2H]- 186.053646 139.3
[M]+ 165.07843142 132.5
[M]- 165.07952858 132.5
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