CID 133063359

Methyl 7-chloro-1h-pyrrolo[3,2-c]pyridine-2-carboxylate

Structural Information

Molecular Formula
C9H7ClN2O2
SMILES
COC(=O)C1=CC2=CN=CC(=C2N1)Cl
InChI
InChI=1S/C9H7ClN2O2/c1-14-9(13)7-2-5-3-11-4-6(10)8(5)12-7/h2-4,12H,1H3
InChIKey
WLVRLRSKYSPFTD-UHFFFAOYSA-N
Compound name
methyl 7-chloro-1H-pyrrolo[3,2-c]pyridine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.0196 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.02688 139.7
[M+Na]+ 233.00882 153.9
[M+NH4]+ 228.05342 147.7
[M+K]+ 248.98276 149.4
[M-H]- 209.01232 140.0
[M+Na-2H]- 230.99427 145.7
[M]+ 210.01905 142.0
[M]- 210.02015 142.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.