CID 155821776

1-ethynyl-n-methylcyclopropane-1-sulfonamide

Structural Information

Molecular Formula
C6H9NO2S
SMILES
CNS(=O)(=O)C1(CC1)C#C
InChI
InChI=1S/C6H9NO2S/c1-3-6(4-5-6)10(8,9)7-2/h1,7H,4-5H2,2H3
InChIKey
OGUSOEFXWQUIMJ-UHFFFAOYSA-N
Compound name
1-ethynyl-N-methylcyclopropane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

159.0354 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.04268 134.1
[M+Na]+ 182.02462 149.9
[M-H]- 158.02812 140.3
[M+NH4]+ 177.06922 152.0
[M+K]+ 197.99856 144.7
[M+H-H2O]+ 142.03266 126.7
[M+HCOO]- 204.03360 149.4
[M+CH3COO]- 218.04925 186.7
[M+Na-2H]- 180.01007 141.1
[M]+ 159.03485 135.0
[M]- 159.03595 135.0
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.