CID 17750400

7-chloro-2-iodothieno[3,2-b]pyridine

Structural Information

Molecular Formula
C7H3ClINS
SMILES
C1=CN=C2C=C(SC2=C1Cl)I
InChI
InChI=1S/C7H3ClINS/c8-4-1-2-10-5-3-6(9)11-7(4)5/h1-3H
InChIKey
GYHAKTKQWPBADS-UHFFFAOYSA-N
Compound name
7-chloro-2-iodothieno[3,2-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

112
Patents

294.87195 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.87923 133.6
[M+Na]+ 317.86117 140.0
[M-H]- 293.86467 131.2
[M+NH4]+ 312.90577 152.1
[M+K]+ 333.83511 141.1
[M+H-H2O]+ 277.86921 125.7
[M+HCOO]- 339.87015 145.2
[M+CH3COO]- 353.88580 144.8
[M+Na-2H]- 315.84662 127.7
[M]+ 294.87140 136.7
[M]- 294.87250 136.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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