CID 56828033

(3-methyl-1,2-oxazol-5-yl)methanesulfonyl chloride

Structural Information

Molecular Formula
C5H6ClNO3S
SMILES
CC1=NOC(=C1)CS(=O)(=O)Cl
InChI
InChI=1S/C5H6ClNO3S/c1-4-2-5(10-7-4)3-11(6,8)9/h2H,3H2,1H3
InChIKey
FDPJZSWTOPFDNI-UHFFFAOYSA-N
Compound name
(3-methyl-1,2-oxazol-5-yl)methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.9757 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.98298 138.0
[M+Na]+ 217.96492 149.7
[M+NH4]+ 213.00952 145.5
[M+K]+ 233.93886 145.0
[M-H]- 193.96842 138.6
[M+Na-2H]- 215.95037 141.7
[M]+ 194.97515 140.4
[M]- 194.97625 140.4
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.