CID 131385454

Methyl 5-bromo-2-cyclopropylpyridine-4-carboxylate

Structural Information

Molecular Formula
C10H10BrNO2
SMILES
COC(=O)C1=CC(=NC=C1Br)C2CC2
InChI
InChI=1S/C10H10BrNO2/c1-14-10(13)7-4-9(6-2-3-6)12-5-8(7)11/h4-6H,2-3H2,1H3
InChIKey
JJZSVHBWGYNQRV-UHFFFAOYSA-N
Compound name
methyl 5-bromo-2-cyclopropylpyridine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

254.98949 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.99677 139.1
[M+Na]+ 277.97871 144.5
[M+NH4]+ 273.02331 144.3
[M+K]+ 293.95265 146.1
[M-H]- 253.98221 146.0
[M+Na-2H]- 275.96416 145.9
[M]+ 254.98894 141.7
[M]- 254.99004 141.7
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.

Patent stripe

patents stripe