CID 122199009

Ethyl 6-bromo-3-hydroxyfuro[3,2-b]pyridine-2-carboxylate

Structural Information

Molecular Formula
C10H8BrNO4
SMILES
CCOC(=O)C1=C(C2=C(O1)C=C(C=N2)Br)O
InChI
InChI=1S/C10H8BrNO4/c1-2-15-10(14)9-8(13)7-6(16-9)3-5(11)4-12-7/h3-4,13H,2H2,1H3
InChIKey
RSZKXMNAKZOMKM-UHFFFAOYSA-N
Compound name
ethyl 6-bromo-3-hydroxyfuro[3,2-b]pyridine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.96368 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.97096 151.5
[M+Na]+ 307.95290 165.6
[M-H]- 283.95640 157.9
[M+NH4]+ 302.99750 171.1
[M+K]+ 323.92684 156.2
[M+H-H2O]+ 267.96094 151.6
[M+HCOO]- 329.96188 171.6
[M+CH3COO]- 343.97753 192.5
[M+Na-2H]- 305.93835 158.6
[M]+ 284.96313 175.7
[M]- 284.96423 175.7
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

No patent data available for this compound.