CID 10313151

6-methyl-1h-pyrrolo[3,2-c]pyridine

Structural Information

Molecular Formula
C8H8N2
SMILES
CC1=CC2=C(C=CN2)C=N1
InChI
InChI=1S/C8H8N2/c1-6-4-8-7(5-10-6)2-3-9-8/h2-5,9H,1H3
InChIKey
PCAVQKASMKODDC-UHFFFAOYSA-N
Compound name
6-methyl-1H-pyrrolo[3,2-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

170
Patents

132.06874 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.076016 123.3
[M+Na]+ 155.057958 134.3
[M-H]- 131.061464 124.7
[M+NH4]+ 150.102563 145.3
[M+K]+ 171.031898 130.7
[M+H-H2O]+ 115.066000 117.0
[M+HCOO]- 177.066941 146.4
[M+CH3COO]- 191.082591 138.0
[M+Na-2H]- 153.043406 132.6
[M]+ 132.06819142 123.5
[M]- 132.06928858 123.5
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