CID 12575516

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

Structural Information

Molecular Formula
C7H5ClN2
SMILES
C1=CNC2=CC(=NC=C21)Cl
InChI
InChI=1S/C7H5ClN2/c8-7-3-6-5(4-10-7)1-2-9-6/h1-4,9H
InChIKey
CBHXTZKXDLDMJZ-UHFFFAOYSA-N
Compound name
6-chloro-1H-pyrrolo[3,2-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

233
Patents

152.01413 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.02141 125.2
[M+Na]+ 175.00335 137.3
[M-H]- 151.00685 126.3
[M+NH4]+ 170.04795 147.0
[M+K]+ 190.97729 132.1
[M+H-H2O]+ 135.01139 119.3
[M+HCOO]- 197.01233 143.7
[M+CH3COO]- 211.02798 139.7
[M+Na-2H]- 172.98880 134.4
[M]+ 152.01358 126.8
[M]- 152.01468 126.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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