CID 119082552

1097732-08-5

Structural Information

Molecular Formula
C9H7ClN2O2S
SMILES
CC1=C2C(=C(C=C1)S(=O)(=O)Cl)N=CC=N2
InChI
InChI=1S/C9H7ClN2O2S/c1-6-2-3-7(15(10,13)14)9-8(6)11-4-5-12-9/h2-5H,1H3
InChIKey
FGMGCIHOSSIWNH-UHFFFAOYSA-N
Compound name
8-methylquinoxaline-5-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.99167 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.998946 146.1
[M+Na]+ 264.980888 158.5
[M-H]- 240.984394 149.0
[M+NH4]+ 260.025493 163.9
[M+K]+ 280.954828 153.4
[M+H-H2O]+ 224.988930 140.4
[M+HCOO]- 286.989871 157.4
[M+CH3COO]- 301.005521 186.8
[M+Na-2H]- 262.966336 153.3
[M]+ 241.99112142 151.6
[M]- 241.99221858 151.6
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

No patent data available for this compound.