CID 211823

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

Structural Information

Molecular Formula
C7H7ClN2
SMILES
C1CNC2=CC(=NC=C21)Cl
InChI
InChI=1S/C7H7ClN2/c8-7-3-6-5(4-10-7)1-2-9-6/h3-4,9H,1-2H2
InChIKey
WSJKRCBUBLIDBF-UHFFFAOYSA-N
Compound name
6-chloro-2,3-dihydro-1H-pyrrolo[3,2-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

76
Patents

154.02977 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.03705 128.7
[M+Na]+ 177.01899 138.6
[M-H]- 153.02249 129.0
[M+NH4]+ 172.06359 150.1
[M+K]+ 192.99293 133.9
[M+H-H2O]+ 137.02703 122.6
[M+HCOO]- 199.02797 144.3
[M+CH3COO]- 213.04362 142.0
[M+Na-2H]- 175.00444 135.7
[M]+ 154.02922 127.3
[M]- 154.03032 127.3
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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