CID 10910170

Methyl 2-methoxy-6-methylnicotinate

Structural Information

Molecular Formula
C9H11NO3
SMILES
CC1=NC(=C(C=C1)C(=O)OC)OC
InChI
InChI=1S/C9H11NO3/c1-6-4-5-7(9(11)13-3)8(10-6)12-2/h4-5H,1-3H3
InChIKey
ZPRQXQNPWCCUOQ-UHFFFAOYSA-N
Compound name
methyl 2-methoxy-6-methylpyridine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

181.0739 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.08118 136.9
[M+Na]+ 204.06312 149.8
[M+NH4]+ 199.10772 144.2
[M+K]+ 220.03706 144.6
[M-H]- 180.06662 137.6
[M+Na-2H]- 202.04857 143.0
[M]+ 181.07335 138.8
[M]- 181.07445 138.8
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

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