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

9
Patents

165.07898 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.08626 132.3
[M+Na]+ 188.06820 140.0
[M-H]- 164.07170 138.8
[M+NH4]+ 183.11280 150.6
[M+K]+ 204.04214 140.8
[M+H-H2O]+ 148.07624 125.8
[M+HCOO]- 210.07718 153.5
[M+CH3COO]- 224.09283 146.4
[M+Na-2H]- 186.05365 139.3
[M]+ 165.07843 132.5
[M]- 165.07953 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