CID 28491317

3-chloro-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid

Structural Information

Molecular Formula
C10H10ClNO3
SMILES
C1CC1COC2=NC(=C(C=C2)Cl)C(=O)O
InChI
InChI=1S/C10H10ClNO3/c11-7-3-4-8(12-9(7)10(13)14)15-5-6-1-2-6/h3-4,6H,1-2,5H2,(H,13,14)
InChIKey
SBSICDYGNMASIM-UHFFFAOYSA-N
Compound name
3-chloro-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.03493 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.04221 146.2
[M+Na]+ 250.02415 160.6
[M+NH4]+ 245.06875 154.3
[M+K]+ 265.99809 156.2
[M-H]- 226.02765 154.6
[M+Na-2H]- 248.00960 155.1
[M]+ 227.03438 151.9
[M]- 227.03548 151.9
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.

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No patent data available for this compound.