CID 64204411

2-(cyclopropylmethoxy)ethane-1-sulfonamide

Structural Information

Molecular Formula
C6H13NO3S
SMILES
C1CC1COCCS(=O)(=O)N
InChI
InChI=1S/C6H13NO3S/c7-11(8,9)4-3-10-5-6-1-2-6/h6H,1-5H2,(H2,7,8,9)
InChIKey
MDTVBVBYYLOKAS-UHFFFAOYSA-N
Compound name
2-(cyclopropylmethoxy)ethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.06161 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.06889 134.2
[M+Na]+ 202.05083 142.8
[M-H]- 178.05433 138.2
[M+NH4]+ 197.09543 149.2
[M+K]+ 218.02477 139.9
[M+H-H2O]+ 162.05887 128.2
[M+HCOO]- 224.05981 152.8
[M+CH3COO]- 238.07546 181.6
[M+Na-2H]- 200.03628 138.5
[M]+ 179.06106 139.2
[M]- 179.06216 139.2
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.