CID 24729224

4-methoxy-1h-pyrrolo[3,2-c]pyridine

Structural Information

Molecular Formula
C8H8N2O
SMILES
COC1=NC=CC2=C1C=CN2
InChI
InChI=1S/C8H8N2O/c1-11-8-6-2-4-9-7(6)3-5-10-8/h2-5,9H,1H3
InChIKey
LNIKWYIVQUDQTM-UHFFFAOYSA-N
Compound name
4-methoxy-1H-pyrrolo[3,2-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

45
Patents

148.06366 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.070936 126.5
[M+Na]+ 171.052878 137.4
[M-H]- 147.056384 127.9
[M+NH4]+ 166.097483 147.7
[M+K]+ 187.026818 134.3
[M+H-H2O]+ 131.060920 120.0
[M+HCOO]- 193.061861 149.8
[M+CH3COO]- 207.077511 141.0
[M+Na-2H]- 169.038326 135.8
[M]+ 148.06311142 128.1
[M]- 148.06420858 128.1
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