CID 14224770

8-methylquinoline-5-sulfonyl chloride

Structural Information

Molecular Formula
C10H8ClNO2S
SMILES
CC1=C2C(=C(C=C1)S(=O)(=O)Cl)C=CC=N2
InChI
InChI=1S/C10H8ClNO2S/c1-7-4-5-9(15(11,13)14)8-3-2-6-12-10(7)8/h2-6H,1H3
InChIKey
JQSKUQBKUDCALN-UHFFFAOYSA-N
Compound name
8-methylquinoline-5-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

240.99643 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.00371 148.4
[M+Na]+ 263.98565 163.7
[M+NH4]+ 259.03025 157.6
[M+K]+ 279.95959 154.5
[M-H]- 239.98915 150.3
[M+Na-2H]- 261.97110 155.5
[M]+ 240.99588 152.1
[M]- 240.99698 152.1
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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