CID 20462682

N-allylethenesulfonamide

Structural Information

Molecular Formula
C5H9NO2S
SMILES
C=CCNS(=O)(=O)C=C
InChI
InChI=1S/C5H9NO2S/c1-3-5-6-9(7,8)4-2/h3-4,6H,1-2,5H2
InChIKey
CHICVXSQEMYXAN-UHFFFAOYSA-N
Compound name
N-prop-2-enylethenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

94
Patents

147.0354 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.042676 127.7
[M+Na]+ 170.024618 135.8
[M-H]- 146.028124 128.4
[M+NH4]+ 165.069223 149.2
[M+K]+ 185.998558 133.3
[M+H-H2O]+ 130.032660 123.1
[M+HCOO]- 192.033601 146.9
[M+CH3COO]- 206.049251 173.4
[M+Na-2H]- 168.010066 132.6
[M]+ 147.03485142 129.3
[M]- 147.03594858 129.3
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

patents stripe