CID 43363654

1086376-81-9

Structural Information

Molecular Formula
C10H8ClNO3S
SMILES
CC1=NC(=CO1)C2=CC=C(C=C2)S(=O)(=O)Cl
InChI
InChI=1S/C10H8ClNO3S/c1-7-12-10(6-15-7)8-2-4-9(5-3-8)16(11,13)14/h2-6H,1H3
InChIKey
HPSZYMHIXLWICC-UHFFFAOYSA-N
Compound name
4-(2-methyl-1,3-oxazol-4-yl)benzenesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.99133 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.99861 153.2
[M+Na]+ 279.98055 167.3
[M+NH4]+ 275.02515 161.3
[M+K]+ 295.95449 161.3
[M-H]- 255.98405 156.7
[M+Na-2H]- 277.96600 159.9
[M]+ 256.99078 157.0
[M]- 256.99188 157.0
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.